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

Systemtic Name: 4-ethanoyl-3,5-dimethyl-N-(4-piperidin-1-ylsulfonylphenyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-3,5-dimethyl-N-[4-(1-piperidylsulfonyl)phenyl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-3,5-dimethyl-N-[4-(1-piperidinylsulfonyl)phenyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-3,5-dimethyl-N-(4-piperidin-1-ylsulfonylphenyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-3,5-dimethyl-N-(4-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=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

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

InChI

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