methyl 2-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C16H17ClN2O4S2 MolecularWeight: 400.90018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2=CC(=C(C=C2OC)OC)Cl)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2=CC(=C(C=C2OC)OC)Cl)C(=O)OC

InChI

InChI=1S/C16H17ClN2O4S2/c1-8-5-9(15(20)23-4)14(25-8)19-16(24)18-11-6-10(17)12(21-2)7-13(11)22-3/h5-7H,1-4H3,(H2,18,19,24)