methyl 4-[[2-(4-chlorophenyl)sulfanylpropanoyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(4-chlorophenyl)sulfanylpropanoyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[2-(4-chlorophenyl)sulfanylpropanoyl-methyl-amino]methyl]benzoate CAS Name: 4-[[[2-[(4-chlorophenyl)thio]-1-oxopropyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-chlorophenyl)sulfanylpropanoyl-methylamino]methyl]benzoate Traditional Name: 4-[[2-[(4-chlorophenyl)thio]propanoyl-methyl-amino]methyl]benzoic acid methyl ester Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC=C(C=C1)C(=O)OC)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)N(C)CC1=CC=C(C=C1)C(=O)OC)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H20ClNO3S/c1-13(25-17-10-8-16(20)9-11-17)18(22)21(2)12-14-4-6-15(7-5-14)19(23)24-3/h4-11,13H,12H2,1-3H3