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

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(cyclopropylcarbamoyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(cyclopropylcarbamoyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-[4-[(cyclopropylamino)-oxomethyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-[4-(cyclopropylcarbamoyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(cyclopropylcarbamoyl)phenyl]isonipecotamide Formula: C22H27N5O5S MolecularWeight: 473.54528

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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=C(C=C3)C(=O)NC4CC4

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C(=O)NC4CC4

InChI

InChI=1S/C22H27N5O5S/c1-26-13-18(12-19(26)20(23)28)33(31,32)27-10-8-15(9-11-27)22(30)24-16-4-2-14(3-5-16)21(29)25-17-6-7-17/h2-5,12-13,15,17H,6-11H2,1H3,(H2,23,28)(H,24,30)(H,25,29)