methyl 5-[(cyclopropylcarbamothioylamino)methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[(cyclopropylcarbamothioylamino)methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[(cyclopropylcarbamothioylamino)methyl]-2-methoxy-benzoate CAS Name: 5-[[[(cyclopropylamino)-sulfanylidenemethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[(cyclopropylcarbamothioylamino)methyl]-2-methoxybenzoate Traditional Name: 5-[(cyclopropylthiocarbamoylamino)methyl]-2-methoxy-benzoic acid methyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=S)NC2CC2)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=S)NC2CC2)C(=O)OC

InChI

InChI=1S/C14H18N2O3S/c1-18-12-6-3-9(7-11(12)13(17)19-2)8-15-14(20)16-10-4-5-10/h3,6-7,10H,4-5,8H2,1-2H3,(H2,15,16,20)