methyl 2-butyl-3-[[2-(2-cyanophenyl)-3-methyl-4-oxidanylidene-quinazolin-6-yl]methyl]benzimidazole-4-carboxylate

Systemtic Name: methyl 2-butyl-3-[[2-(2-cyanophenyl)-3-methyl-4-oxidanylidene-quinazolin-6-yl]methyl]benzimidazole-4-carboxylate Openeye Name: methyl 2-butyl-3-[[2-(2-cyanophenyl)-3-methyl-4-oxo-quinazolin-6-yl]methyl]benzimidazole-4-carboxylate CAS Name: 2-butyl-3-[[2-(2-cyanophenyl)-3-methyl-4-oxo-6-quinazolinyl]methyl]-4-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-butyl-3-[[2-(2-cyanophenyl)-3-methyl-4-oxoquinazolin-6-yl]methyl]benzimidazole-4-carboxylate Traditional Name: 2-butyl-3-[[2-(2-cyanophenyl)-4-keto-3-methyl-quinazolin-6-yl]methyl]benzimidazole-4-carboxylic acid methyl ester Formula: C30H27N5O3 MolecularWeight: 505.56708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC(=C2N1CC3=CC4=C(C=C3)N=C(N(C4=O)C)C5=CC=CC=C5C#N)C(=O)OC

Isomeric SMILES

CCCCC1=NC2=CC=CC(=C2N1CC3=CC4=C(C=C3)N=C(N(C4=O)C)C5=CC=CC=C5C#N)C(=O)OC

InChI

InChI=1S/C30H27N5O3/c1-4-5-13-26-32-25-12-8-11-22(30(37)38-3)27(25)35(26)18-19-14-15-24-23(16-19)29(36)34(2)28(33-24)21-10-7-6-9-20(21)17-31/h6-12,14-16H,4-5,13,18H2,1-3H3