methyl 2-methyl-3-[2-(naphthalen-2-ylmethylsulfanyl)ethanoylamino]benzoate

Systemtic Name: methyl 2-methyl-3-[2-(naphthalen-2-ylmethylsulfanyl)ethanoylamino]benzoate Openeye Name: methyl 2-methyl-3-[[2-(2-naphthylmethylsulfanyl)acetyl]amino]benzoate CAS Name: 2-methyl-3-[[2-(2-naphthalenylmethylthio)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-[[2-(naphthalen-2-ylmethylsulfanyl)acetyl]amino]benzoate Traditional Name: 2-methyl-3-[[2-(2-naphthylmethylthio)acetyl]amino]benzoic acid methyl ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CSCC2=CC3=CC=CC=C3C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CSCC2=CC3=CC=CC=C3C=C2)C(=O)OC

InChI

InChI=1S/C22H21NO3S/c1-15-19(22(25)26-2)8-5-9-20(15)23-21(24)14-27-13-16-10-11-17-6-3-4-7-18(17)12-16/h3-12H,13-14H2,1-2H3,(H,23,24)