methyl 3-(2-cyclopentylsulfanylethylcarbamoyl)benzoate

Systemtic Name: methyl 3-(2-cyclopentylsulfanylethylcarbamoyl)benzoate Openeye Name: methyl 3-(2-cyclopentylsulfanylethylcarbamoyl)benzoate CAS Name: 3-[[2-(cyclopentylthio)ethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-(2-cyclopentylsulfanylethylcarbamoyl)benzoate Traditional Name: 3-[2-(cyclopentylthio)ethylcarbamoyl]benzoic acid methyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NCCSC2CCCC2

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NCCSC2CCCC2

InChI

InChI=1S/C16H21NO3S/c1-20-16(19)13-6-4-5-12(11-13)15(18)17-9-10-21-14-7-2-3-8-14/h4-6,11,14H,2-3,7-10H2,1H3,(H,17,18)