3-(3-methylphenyl)-3-[(4-nitrophenyl)amino]-1-(5-sulfanylidene-2H-furan-4-yl)propan-1-one

Systemtic Name: 3-(3-methylphenyl)-3-[(4-nitrophenyl)amino]-1-(5-sulfanylidene-2H-furan-4-yl)propan-1-one Openeye Name: 3-(m-tolyl)-3-(4-nitroanilino)-1-(5-thioxo-2H-furan-4-yl)propan-1-one CAS Name: 3-(3-methylphenyl)-3-(4-nitroanilino)-1-(5-sulfanylidene-2H-furan-4-yl)-1-propanone IUPAC Name: 3-(3-methylphenyl)-3-(4-nitroanilino)-1-(5-sulfanylidene-2H-furan-4-yl)propan-1-one Traditional Name: 3-(m-tolyl)-3-(4-nitroanilino)-1-(5-thioxo-2H-furan-4-yl)propan-1-one Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)C2=CCOC2=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)C(CC(=O)C2=CCOC2=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O4S/c1-13-3-2-4-14(11-13)18(12-19(23)17-9-10-26-20(17)27)21-15-5-7-16(8-6-15)22(24)25/h2-9,11,18,21H,10,12H2,1H3