2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-(4-pyrrolidin-1-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-(4-pyrrolidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenyl)sulfanyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-[(4-bromo-2-methylphenyl)thio]-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-(4-bromo-2-methylphenyl)sulfanyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3

InChI

InChI=1S/C20H21BrN2O2S/c1-14-12-16(21)6-9-18(14)26-13-19(24)22-17-7-4-15(5-8-17)20(25)23-10-2-3-11-23/h4-9,12H,2-3,10-11,13H2,1H3,(H,22,24)