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

Systemtic Name: N-[4,5-dimethyl-1-(phenylmethyl)-3-(phenylsulfonyl)pyrrol-2-yl]ethanamide Openeye Name: N-[3-(benzenesulfonyl)-1-benzyl-4,5-dimethyl-pyrrol-2-yl]acetamide CAS Name: N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(phenylmethyl)-2-pyrrolyl]acetamide IUPAC Name: N-[3-(benzenesulfonyl)-1-benzyl-4,5-dimethylpyrrol-2-yl]acetamide Traditional Name: N-(1-benzyl-3-besyl-4,5-dimethyl-pyrrol-2-yl)acetamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C)CC3=CC=CC=C3)C

InChI

InChI=1S/C21H22N2O3S/c1-15-16(2)23(14-18-10-6-4-7-11-18)21(22-17(3)24)20(15)27(25,26)19-12-8-5-9-13-19/h4-13H,14H2,1-3H3,(H,22,24)