07C

2-methylsulfanyl-10-nitro-pyrido[3,4-g]quinazoline

Created:2021-06-01
Last modified:  2021-07-21

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Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count0
Bond Count29
Aromatic Bond Count16
2D diagram of 07C

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Toggle HydrogenToggle Labels

Chemical Component Summary

Name2-methylsulfanyl-10-nitro-pyrido[3,4-g]quinazoline
Systematic Name (OpenEye OEToolkits)2-methylsulfanyl-10-nitro-pyrido[3,4-g]quinazoline
FormulaC12 H8 N4 O2 S
Molecular Weight272.283
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385CSc1ncc2cc3cnccc3c(c2n1)[N+]([O-])=O
SMILESOpenEye OEToolkits2.0.7CSc1ncc2cc3cnccc3c(c2n1)[N+](=O)[O-]
Canonical SMILESCACTVS3.385 CSc1ncc2cc3cnccc3c(c2n1)[N+]([O-])=O
Canonical SMILESOpenEye OEToolkits2.0.7 CSc1ncc2cc3cnccc3c(c2n1)[N+](=O)[O-]
InChIInChI1.03 InChI=1S/C12H8N4O2S/c1-19-12-14-6-8-4-7-5-13-3-2-9(7)11(16(17)18)10(8)15-12/h2-6H,1H3
InChIKeyInChI1.03 FAEYQDREFVLABR-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 156009110