methyl 4-(cyclopropylcarbonylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(cyclopropylcarbonylcarbamothioylamino)benzoate Openeye Name: methyl 4-(cyclopropanecarbonylcarbamothioylamino)benzoate CAS Name: 4-[[[[cyclopropyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(cyclopropanecarbonylcarbamothioylamino)benzoate Traditional Name: 4-(cyclopropanecarbonylthiocarbamoylamino)benzoic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2CC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2CC2

InChI

InChI=1S/C13H14N2O3S/c1-18-12(17)9-4-6-10(7-5-9)14-13(19)15-11(16)8-2-3-8/h4-8H,2-3H2,1H3,(H2,14,15,16,19)