methyl 3-(3-methoxypropylcarbamothioylcarbamoyl)benzoate

Systemtic Name: methyl 3-(3-methoxypropylcarbamothioylcarbamoyl)benzoate Openeye Name: methyl 3-(3-methoxypropylcarbamothioylcarbamoyl)benzoate CAS Name: 3-[[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-(3-methoxypropylcarbamothioylcarbamoyl)benzoate Traditional Name: 3-(3-methoxypropylthiocarbamoylcarbamoyl)benzoic acid methyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC(=O)C1=CC(=CC=C1)C(=O)OC

Isomeric SMILES

COCCCNC(=S)NC(=O)C1=CC(=CC=C1)C(=O)OC

InChI

InChI=1S/C14H18N2O4S/c1-19-8-4-7-15-14(21)16-12(17)10-5-3-6-11(9-10)13(18)20-2/h3,5-6,9H,4,7-8H2,1-2H3,(H2,15,16,17,21)