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

Systemtic Name: methyl 3-[2-(naphthalen-2-ylmethylsulfanyl)ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(2-naphthylmethylsulfanyl)acetyl]amino]benzoate CAS Name: 3-[[2-(2-naphthalenylmethylthio)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(naphthalen-2-ylmethylsulfanyl)acetyl]amino]benzoate Traditional Name: 3-[[2-(2-naphthylmethylthio)acetyl]amino]benzoic acid methyl ester Formula: C21H19NO3S MolecularWeight: 365.44546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CSCC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CSCC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H19NO3S/c1-25-21(24)18-7-4-8-19(12-18)22-20(23)14-26-13-15-9-10-16-5-2-3-6-17(16)11-15/h2-12H,13-14H2,1H3,(H,22,23)