N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)pyrrol-2-yl]butanamide

Systemtic Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)pyrrol-2-yl]butanamide Openeye Name: N-[1-isobutyl-4,5-dimethyl-3-(p-tolylsulfonyl)pyrrol-2-yl]butanamide CAS Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)-2-pyrrolyl]butanamide IUPAC Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)pyrrol-2-yl]butanamide Traditional Name: N-(1-isobutyl-4,5-dimethyl-3-tosyl-pyrrol-2-yl)butyramide Formula: C21H30N2O3S MolecularWeight: 390.5395

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(N1CC(C)C)C)C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(N1CC(C)C)C)C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H30N2O3S/c1-7-8-19(24)22-21-20(16(5)17(6)23(21)13-14(2)3)27(25,26)18-11-9-15(4)10-12-18/h9-12,14H,7-8,13H2,1-6H3,(H,22,24)