N-(3-nitrophenyl)-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-nitrophenyl)-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]ethanamide Openeye Name: N-(3-nitrophenyl)-2-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]acetamide CAS Name: N-(3-nitrophenyl)-2-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)thio]acetamide IUPAC Name: N-(3-nitrophenyl)-2-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)thio]-N-(3-nitrophenyl)acetamide Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N=C(N2)SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C(=O)N=C(N2)SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O4S/c21-14(17-10-4-3-5-11(8-10)20(23)24)9-25-16-18-13-7-2-1-6-12(13)15(22)19-16/h3-5,8H,1-2,6-7,9H2,(H,17,21)(H,18,19,22)