2-azanyl-5-(4-nitrophenyl)sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one

Systemtic Name: 2-azanyl-5-(4-nitrophenyl)sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one Openeye Name: 2-amino-5-(4-nitrophenyl)sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one CAS Name: 2-amino-5-[(4-nitrophenyl)thio]-5,6,7,8-tetrahydro-1H-quinazolin-4-one IUPAC Name: 2-amino-5-(4-nitrophenyl)sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one Traditional Name: 2-amino-5-[(4-nitrophenyl)thio]-5,6,7,8-tetrahydro-1H-quinazolin-4-one Formula: C14H14N4O3S MolecularWeight: 318.35096

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)NC(=NC2=O)N)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(C2=C(C1)NC(=NC2=O)N)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O3S/c15-14-16-10-2-1-3-11(12(10)13(19)17-14)22-9-6-4-8(5-7-9)18(20)21/h4-7,11H,1-3H2,(H3,15,16,17,19)