methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(2,6-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-3-oxo-butanoate CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[[3-(2,6-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(2,6-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-oxobutanoate Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[[3-(2,6-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-3-keto-butyric acid methyl ester Formula: C28H24N4O4S MolecularWeight: 512.57956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(=C4NC5=CC=CC=C5N4)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(=C4NC5=CC=CC=C5N4)C(=O)OC

InChI

InChI=1S/C28H24N4O4S/c1-16-9-8-10-17(2)24(16)32-26(34)18-11-4-5-12-19(18)31-28(32)37-15-22(33)23(27(35)36-3)25-29-20-13-6-7-14-21(20)30-25/h4-14,29-30H,15H2,1-3H3