2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]ethanamide

Systemtic Name: 2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]ethanamide Openeye Name: N-[(Z)-1-(3-nitrophenyl)ethylideneamino]-2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]acetamide IUPAC Name: 2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]acetamide Traditional Name: 2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]acetamide Formula: C25H21N5O4S MolecularWeight: 487.53034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=C(C)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N/N=C(/C)\C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H21N5O4S/c1-16-10-12-19(13-11-16)29-24(32)21-8-3-4-9-22(21)26-25(29)35-15-23(31)28-27-17(2)18-6-5-7-20(14-18)30(33)34/h3-14H,15H2,1-2H3,(H,28,31)/b27-17-