methyl (6S)-5-(4-cyanophenyl)sulfonyl-3-propyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylate

Systemtic Name: methyl (6S)-5-(4-cyanophenyl)sulfonyl-3-propyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylate Openeye Name: methyl (6S)-5-(4-cyanophenyl)sulfonyl-3-propyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylate CAS Name: (6S)-5-(4-cyanophenyl)sulfonyl-3-propyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl (6S)-5-(4-cyanophenyl)sulfonyl-3-propyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylate Traditional Name: (6S)-5-(4-cyanophenyl)sulfonyl-3-propyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid methyl ester Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1CN(C(C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCN1C=NC2=C1CN([C@@H](C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H20N4O4S/c1-3-8-21-12-20-15-9-16(18(23)26-2)22(11-17(15)21)27(24,25)14-6-4-13(10-19)5-7-14/h4-7,12,16H,3,8-9,11H2,1-2H3/t16-/m0/s1