ethyl 4-[2-[(2-bromophenyl)methylsulfanyl]ethanoylamino]-3-methyl-benzoate

Systemtic Name: ethyl 4-[2-[(2-bromophenyl)methylsulfanyl]ethanoylamino]-3-methyl-benzoate Openeye Name: ethyl 4-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-methyl-benzoate CAS Name: 4-[[2-[(2-bromophenyl)methylthio]-1-oxoethyl]amino]-3-methylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]amino]-3-methylbenzoate Traditional Name: 4-[[2-[(2-bromobenzyl)thio]acetyl]amino]-3-methyl-benzoic acid ethyl ester Formula: C19H20BrNO3S MolecularWeight: 422.336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CSCC2=CC=CC=C2Br)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CSCC2=CC=CC=C2Br)C

InChI

InChI=1S/C19H20BrNO3S/c1-3-24-19(23)14-8-9-17(13(2)10-14)21-18(22)12-25-11-15-6-4-5-7-16(15)20/h4-10H,3,11-12H2,1-2H3,(H,21,22)