2-[2-(3-chlorophenyl)sulfanyl-4-(hydroxymethyl)-5-methyl-3-propan-2-yl-pyrrol-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[2-(3-chlorophenyl)sulfanyl-4-(hydroxymethyl)-5-methyl-3-propan-2-yl-pyrrol-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[2-(3-chlorophenyl)sulfanyl-4-(hydroxymethyl)-3-isopropyl-5-methyl-pyrrol-1-yl]acetamide CAS Name: 2-[2-[(3-chlorophenyl)thio]-4-(hydroxymethyl)-5-methyl-3-propan-2-yl-1-pyrrolyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[2-(3-chlorophenyl)sulfanyl-4-(hydroxymethyl)-5-methyl-3-propan-2-ylpyrrol-1-yl]acetamide Traditional Name: N-benzyl-2-[2-[(3-chlorophenyl)thio]-3-isopropyl-5-methyl-4-methylol-pyrrol-1-yl]acetamide Formula: C24H27ClN2O2S MolecularWeight: 443.00138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC(=O)NCC2=CC=CC=C2)SC3=CC(=CC=C3)Cl)C(C)C)CO

Isomeric SMILES

CC1=C(C(=C(N1CC(=O)NCC2=CC=CC=C2)SC3=CC(=CC=C3)Cl)C(C)C)CO

InChI

InChI=1S/C24H27ClN2O2S/c1-16(2)23-21(15-28)17(3)27(24(23)30-20-11-7-10-19(25)12-20)14-22(29)26-13-18-8-5-4-6-9-18/h4-12,16,28H,13-15H2,1-3H3,(H,26,29)