AC1O17AR

6,6-dimethyl-2-methylsulfanyl-9-(3-nitrophenyl)-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one

Also Known As: 6,6-dimethyl-2-(methylsulfanyl)-9-(3-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|6,6-DIMETHYL-2-(METHYLSULFANYL)-9-(3-NITROPHENYL)-4H,5H,6H,7H,8H,9H-[1,2,4]TRIAZOLO[3,2-B]QUINAZOLIN-8-ONE|6,6-dimethyl-2-(methylsulfanyl)-9-(3-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol|6,6-dimethyl-2-(methylthio)-9-(3-nitrophenyl)-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|6,6-dimethyl-2-methylsulfanyl-9-(3-nitrophenyl)-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one|6,6-dimethyl-2-methylthio-9-(3-nitrophenyl)-4,5,6,7,9,10-hexahydro-1,2,4-triaz olo[5,1-b]quinazolin-8-one

Molecular Formula	C18H19N5O3S
Molecular Weight	385.12085 g/mol
LogP	3.5663
Topological Polar Surface Area	102.95 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	3
Exact Mass	385.12085
Monoisotopic Mass	385.12085
Heavy Atoms	27
Complexity	994.63336

Chemical Identifiers

CAS Number	727403-46-5
SMILES	CC1(CC2=C(C(N3C(=NC(=N3)SC)N2)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C1)C