1-methyl-N-[2-(2-methylpropylcarbamoyl)phenyl]-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-N-[2-(2-methylpropylcarbamoyl)phenyl]-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[2-(isobutylcarbamoyl)phenyl]-1-methyl-4-(1-piperidylsulfonyl)pyrrole-2-carboxamide CAS Name: 1-methyl-N-[2-[(2-methylpropylamino)-oxomethyl]phenyl]-4-(1-piperidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: 1-methyl-N-[2-(2-methylpropylcarbamoyl)phenyl]-4-piperidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-[2-(isobutylcarbamoyl)phenyl]-1-methyl-4-piperidinosulfonyl-pyrrole-2-carboxamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)CNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H30N4O4S/c1-16(2)14-23-21(27)18-9-5-6-10-19(18)24-22(28)20-13-17(15-25(20)3)31(29,30)26-11-7-4-8-12-26/h5-6,9-10,13,15-16H,4,7-8,11-12,14H2,1-3H3,(H,23,27)(H,24,28)