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

Systemtic Name: methyl 2-(cyclohexylcarbamothioylamino)-4,5-dimethoxy-benzoate Openeye Name: methyl 2-(cyclohexylcarbamothioylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-(cyclohexylcarbamothioylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclohexylthiocarbamoylamino)-4,5-dimethoxy-benzoic acid methyl ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=S)NC2CCCCC2)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=S)NC2CCCCC2)OC

InChI

InChI=1S/C17H24N2O4S/c1-21-14-9-12(16(20)23-3)13(10-15(14)22-2)19-17(24)18-11-7-5-4-6-8-11/h9-11H,4-8H2,1-3H3,(H2,18,19,24)