Chemical Component Summary

Name2-METHYL-N-[(1Z)-3-NITROCYCLOHEXA-2,4-DIEN-1-YLIDENE]-4,5-DIHYDRO[1,3]THIAZOLO[4,5-H]QUINAZOLIN-8-AMINE
IdentifiersN-(2-methyl-4,5-dihydropyrimido[5,4-g][1,3]benzothiazol-8-yl)-3-nitro-cyclohexa-2,4-dien-1-imine
FormulaC16 H13 N5 O2 S
Molecular Weight339.372
TypeNON-POLYMER
Isomeric SMILESCc1nc2c(s1)-c3c(cnc(n3)N=C4CC=CC(=C4)[N+](=O)[O-])CC2
InChIInChI=1S/C16H13N5O2S/c1-9-18-13-6-5-10-8-17-16(20-14(10)15(13)24-9)19-11-3-2-4-12(7-11)21(22)23/h2,4,7-8H,3,5-6H2,1H3/b19-11-
InChIKeyCMWWYSDXIZEJPA-ODLFYWEKSA-N

Chemical Details

Formal Charge0
Atom Count37
Chiral Atom Count0
Bond Count40
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 49867829