ZMX

(2M)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzamide

Created: 2023-06-29
Last modified:  2024-07-03

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Chemical Details

Formal Charge0
Atom Count59
Chiral Atom Count0
Bond Count63
Aromatic Bond Count23
2D diagram of ZMX
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Chemical Component Summary

Name(2M)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzamide
Systematic Name (OpenEye OEToolkits)~{N}-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzamide
FormulaC28 H24 N4 O3
Molecular Weight464.515
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01CC=1N(C)N(c2ccccc2)C(=O)C=1NC(=O)c1ccccc1c1ncc(o1)c1ccc(C)cc1
SMILESCACTVS3.385CN1N(C(=O)C(=C1C)NC(=O)c2ccccc2c3oc(cn3)c4ccc(C)cc4)c5ccccc5
SMILESOpenEye OEToolkits2.0.7Cc1ccc(cc1)c2cnc(o2)c3ccccc3C(=O)NC4=C(N(N(C4=O)c5ccccc5)C)C
Canonical SMILESCACTVS3.385 CN1N(C(=O)C(=C1C)NC(=O)c2ccccc2c3oc(cn3)c4ccc(C)cc4)c5ccccc5
Canonical SMILESOpenEye OEToolkits2.0.7 Cc1ccc(cc1)c2cnc(o2)c3ccccc3C(=O)NC4=C(N(N(C4=O)c5ccccc5)C)C
InChIInChI1.06 InChI=1S/C28H24N4O3/c1-18-13-15-20(16-14-18)24-17-29-27(35-24)23-12-8-7-11-22(23)26(33)30-25-19(2)31(3)32(28(25)34)21-9-5-4-6-10-21/h4-17H,1-3H3,(H,30,33)
InChIKeyInChI1.06 MWAFTVRXNXVJSM-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 17537143