methyl 2-(cyclopentylcarbamothioylamino)-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-(cyclopentylcarbamothioylamino)-4,5-dimethoxy-benzoate Openeye Name: methyl 2-(cyclopentylcarbamothioylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[(cyclopentylamino)-sulfanylidenemethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-(cyclopentylcarbamothioylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclopentylthiocarbamoylamino)-4,5-dimethoxy-benzoic acid methyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=S)NC2CCCC2)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=S)NC2CCCC2)OC

InChI

InChI=1S/C16H22N2O4S/c1-20-13-8-11(15(19)22-3)12(9-14(13)21-2)18-16(23)17-10-6-4-5-7-10/h8-10H,4-7H2,1-3H3,(H2,17,18,23)