2-(1,3-dimethylbenzimidazol-2-ylidene)-4-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxo-4-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-4-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-4-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]butyronitrile Formula: C28H23N5O2S MolecularWeight: 493.57952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(=C4N(C5=CC=CC=C5N4C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(=C4N(C5=CC=CC=C5N4C)C)C#N

InChI

InChI=1S/C28H23N5O2S/c1-18-12-14-19(15-13-18)33-27(35)20-8-4-5-9-22(20)30-28(33)36-17-25(34)21(16-29)26-31(2)23-10-6-7-11-24(23)32(26)3/h4-15H,17H2,1-3H3