methyl 4-(carbamothioylamino)benzoate

Systemtic Name: methyl 4-(carbamothioylamino)benzoate Openeye Name: methyl 4-(carbamothioylamino)benzoate CAS Name: 4-(carbamothioylamino)benzoic acid methyl ester IUPAC Name: methyl 4-(carbamothioylamino)benzoate Traditional Name: 4-thioureidobenzoic acid methyl ester Formula: C9H10N2O2S MolecularWeight: 210.2529

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O2S/c1-13-8(12)6-2-4-7(5-3-6)11-9(10)14/h2-5H,1H3,(H3,10,11,14)