ethyl 1-[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazol-5-yl]sulfonylpyrrolidine-2-carboxylate

Systemtic Name: ethyl 1-[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazol-5-yl]sulfonylpyrrolidine-2-carboxylate Openeye Name: ethyl 1-[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazol-5-yl]sulfonylpyrrolidine-2-carboxylate CAS Name: 1-[[2-[(4-cyanophenyl)methyl]-1-methyl-5-benzimidazolyl]sulfonyl]-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-cyanophenyl)methyl]-1-methylbenzimidazol-5-yl]sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-[2-(4-cyanobenzyl)-1-methyl-benzimidazol-5-yl]sulfonylpyrrolidine-2-carboxylic acid ethyl ester Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=N3)CC4=CC=C(C=C4)C#N)C

Isomeric SMILES

CCOC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=N3)CC4=CC=C(C=C4)C#N)C

InChI

InChI=1S/C23H24N4O4S/c1-3-31-23(28)21-5-4-12-27(21)32(29,30)18-10-11-20-19(14-18)25-22(26(20)2)13-16-6-8-17(15-24)9-7-16/h6-11,14,21H,3-5,12-13H2,1-2H3