N-[4,5-dimethyl-3-(phenylsulfonyl)-1-propyl-pyrrol-2-yl]butanamide

Systemtic Name: N-[4,5-dimethyl-3-(phenylsulfonyl)-1-propyl-pyrrol-2-yl]butanamide Openeye Name: N-[3-(benzenesulfonyl)-4,5-dimethyl-1-propyl-pyrrol-2-yl]butanamide CAS Name: N-[3-(benzenesulfonyl)-4,5-dimethyl-1-propyl-2-pyrrolyl]butanamide IUPAC Name: N-[3-(benzenesulfonyl)-4,5-dimethyl-1-propylpyrrol-2-yl]butanamide Traditional Name: N-(3-besyl-4,5-dimethyl-1-propyl-pyrrol-2-yl)butyramide Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(N1CCC)C)C)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(N1CCC)C)C)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H26N2O3S/c1-5-10-17(22)20-19-18(14(3)15(4)21(19)13-6-2)25(23,24)16-11-8-7-9-12-16/h7-9,11-12H,5-6,10,13H2,1-4H3,(H,20,22)