methyl 3-[(5-chloranyl-2-methoxy-phenyl)carbamothioylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(5-chloranyl-2-methoxy-phenyl)carbamothioylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(5-chloro-2-methoxy-phenyl)carbamothioylamino]thiophene-2-carboxylate CAS Name: 3-[[(5-chloro-2-methoxyanilino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2-methoxyphenyl)carbamothioylamino]thiophene-2-carboxylate Traditional Name: 3-[(5-chloro-2-methoxy-phenyl)thiocarbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C14H13ClN2O3S2 MolecularWeight: 356.84762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=S)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=S)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C14H13ClN2O3S2/c1-19-11-4-3-8(15)7-10(11)17-14(21)16-9-5-6-22-12(9)13(18)20-2/h3-7H,1-2H3,(H2,16,17,21)