3-[2-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]ethanoylamino]-N-methyl-benzamide

Systemtic Name: 3-[2-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]ethanoylamino]-N-methyl-benzamide Openeye Name: 3-[[2-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]acetyl]amino]-N-methyl-benzamide CAS Name: 3-[[2-[(3-bromo-4-methoxyphenyl)methylthio]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 3-[[2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]acetyl]amino]-N-methylbenzamide Traditional Name: 3-[[2-[(3-bromo-4-methoxy-benzyl)thio]acetyl]amino]-N-methyl-benzamide Formula: C18H19BrN2O3S MolecularWeight: 423.32406

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)NC(=O)CSCC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)NC(=O)CSCC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C18H19BrN2O3S/c1-20-18(23)13-4-3-5-14(9-13)21-17(22)11-25-10-12-6-7-16(24-2)15(19)8-12/h3-9H,10-11H2,1-2H3,(H,20,23)(H,21,22)