3-acetamido-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(4-methylphenyl)sulfanyl-benzamide

Systemtic Name: 3-acetamido-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(4-methylphenyl)sulfanyl-benzamide Openeye Name: 3-acetamido-N-[(5-bromo-2-methoxy-phenyl)methyl]-4-(p-tolylsulfanyl)benzamide CAS Name: 3-acetamido-N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(4-methylphenyl)thio]benzamide IUPAC Name: 3-acetamido-N-[(5-bromo-2-methoxyphenyl)methyl]-4-(4-methylphenyl)sulfanylbenzamide Traditional Name: 3-acetamido-N-(5-bromo-2-methoxy-benzyl)-4-(p-tolylthio)benzamide Formula: C24H23BrN2O3S MolecularWeight: 499.42002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCC3=C(C=CC(=C3)Br)OC)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCC3=C(C=CC(=C3)Br)OC)NC(=O)C

InChI

InChI=1S/C24H23BrN2O3S/c1-15-4-8-20(9-5-15)31-23-11-6-17(13-21(23)27-16(2)28)24(29)26-14-18-12-19(25)7-10-22(18)30-3/h4-13H,14H2,1-3H3,(H,26,29)(H,27,28)