1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(3-cyanophenyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(3-cyanophenyl)piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(3-cyanophenyl)piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-(3-cyanophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-(3-cyanophenyl)piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(3-cyanophenyl)isonipecotamide Formula: C19H21N5O4S MolecularWeight: 415.46614

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H21N5O4S/c1-23-12-16(10-17(23)18(21)25)29(27,28)24-7-5-14(6-8-24)19(26)22-15-4-2-3-13(9-15)11-20/h2-4,9-10,12,14H,5-8H2,1H3,(H2,21,25)(H,22,26)