2,5-dimethyl-N-(4-piperidin-1-ylsulfonylphenyl)-1-propan-2-yl-pyrrole-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-(4-piperidin-1-ylsulfonylphenyl)-1-propan-2-yl-pyrrole-3-carboxamide Openeye Name: 1-isopropyl-2,5-dimethyl-N-[4-(1-piperidylsulfonyl)phenyl]pyrrole-3-carboxamide CAS Name: 2,5-dimethyl-N-[4-(1-piperidinylsulfonyl)phenyl]-1-propan-2-yl-3-pyrrolecarboxamide IUPAC Name: 2,5-dimethyl-N-(4-piperidin-1-ylsulfonylphenyl)-1-propan-2-ylpyrrole-3-carboxamide Traditional Name: 1-isopropyl-2,5-dimethyl-N-(4-piperidinosulfonylphenyl)pyrrole-3-carboxamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H29N3O3S/c1-15(2)24-16(3)14-20(17(24)4)21(25)22-18-8-10-19(11-9-18)28(26,27)23-12-6-5-7-13-23/h8-11,14-15H,5-7,12-13H2,1-4H3,(H,22,25)