methyl 3-(cyclopentylcarbamothioylcarbamoyl)benzoate

Systemtic Name: methyl 3-(cyclopentylcarbamothioylcarbamoyl)benzoate Openeye Name: methyl 3-(cyclopentylcarbamothioylcarbamoyl)benzoate CAS Name: 3-[[[(cyclopentylamino)-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-(cyclopentylcarbamothioylcarbamoyl)benzoate Traditional Name: 3-(cyclopentylthiocarbamoylcarbamoyl)benzoic acid methyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NC(=S)NC2CCCC2

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NC(=S)NC2CCCC2

InChI

InChI=1S/C15H18N2O3S/c1-20-14(19)11-6-4-5-10(9-11)13(18)17-15(21)16-12-7-2-3-8-12/h4-6,9,12H,2-3,7-8H2,1H3,(H2,16,17,18,21)