2-cyanoethyl 4-(3-chlorophenyl)-5-(3-imidazol-1-ylpropylcarbamoyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-cyanoethyl 4-(3-chlorophenyl)-5-(3-imidazol-1-ylpropylcarbamoyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-cyanoethyl 4-(3-chlorophenyl)-5-(3-imidazol-1-ylpropylcarbamoyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(3-chlorophenyl)-5-[[3-(1-imidazolyl)propylamino]-oxomethyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 4-(3-chlorophenyl)-5-(3-imidazol-1-ylpropylcarbamoyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(3-chlorophenyl)-5-(3-imidazol-1-ylpropylcarbamoyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid 2-cyanoethyl ester Formula: C24H26ClN5O3 MolecularWeight: 467.94794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCC#N)C2=CC(=CC=C2)Cl)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCC#N)C2=CC(=CC=C2)Cl)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C24H26ClN5O3/c1-16-20(23(31)28-9-5-11-30-12-10-27-15-30)22(18-6-3-7-19(25)14-18)21(17(2)29-16)24(32)33-13-4-8-26/h3,6-7,10,12,14-15,22,29H,4-5,9,11,13H2,1-2H3,(H,28,31)