4-bromanyl-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide

Systemtic Name: 4-bromanyl-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide Openeye Name: 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide CAS Name: 4-bromo-N-[2-methyl-4-[(phenylthio)methyl]phenyl]benzamide IUPAC Name: 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide Traditional Name: 4-bromo-N-[2-methyl-4-[(phenylthio)methyl]phenyl]benzamide Formula: C21H18BrNOS MolecularWeight: 412.34272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrNOS/c1-15-13-16(14-25-19-5-3-2-4-6-19)7-12-20(15)23-21(24)17-8-10-18(22)11-9-17/h2-13H,14H2,1H3,(H,23,24)