1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(2,2-dimethylpropanoylamino)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(2,2-dimethylpropanoylamino)phenyl]piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(2,2-dimethylpropanoylamino)phenyl]piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-[4-(2,2-dimethylpropanoylamino)phenyl]piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(pivaloylamino)phenyl]isonipecotamide Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C

InChI

InChI=1S/C23H31N5O5S/c1-23(2,3)22(31)26-17-7-5-16(6-8-17)25-21(30)15-9-11-28(12-10-15)34(32,33)18-13-19(20(24)29)27(4)14-18/h5-8,13-15H,9-12H2,1-4H3,(H2,24,29)(H,25,30)(H,26,31)