methyl 4-(cyclopropylmethylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(cyclopropylmethylcarbamothioylamino)benzoate Openeye Name: methyl 4-(cyclopropylmethylcarbamothioylamino)benzoate CAS Name: 4-[[(cyclopropylmethylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(cyclopropylmethylcarbamothioylamino)benzoate Traditional Name: 4-(cyclopropylmethylthiocarbamoylamino)benzoic acid methyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NCC2CC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NCC2CC2

InChI

InChI=1S/C13H16N2O2S/c1-17-12(16)10-4-6-11(7-5-10)15-13(18)14-8-9-2-3-9/h4-7,9H,2-3,8H2,1H3,(H2,14,15,18)