4-ethanoyl-3,5-dimethyl-N-(3-piperidin-1-ylsulfonylphenyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-3,5-dimethyl-N-(3-piperidin-1-ylsulfonylphenyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-3,5-dimethyl-N-[3-(1-piperidylsulfonyl)phenyl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-3,5-dimethyl-N-[3-(1-piperidinylsulfonyl)phenyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-3,5-dimethyl-N-(3-piperidin-1-ylsulfonylphenyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-3,5-dimethyl-N-(3-piperidinosulfonylphenyl)-1H-pyrrole-2-carboxamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H25N3O4S/c1-13-18(15(3)24)14(2)21-19(13)20(25)22-16-8-7-9-17(12-16)28(26,27)23-10-5-4-6-11-23/h7-9,12,21H,4-6,10-11H2,1-3H3,(H,22,25)