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

Systemtic Name: methyl 2-[[2,3-bis(chloranyl)phenyl]carbamothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2,3-dichlorophenyl)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(2,3-dichloroanilino)-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,3-dichlorophenyl)carbamothioylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[(2,3-dichlorophenyl)thiocarbamoylamino]-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C19H14Cl2N2O2S2 MolecularWeight: 437.36266

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C19H14Cl2N2O2S2/c1-25-18(24)12-10-15(11-6-3-2-4-7-11)27-17(12)23-19(26)22-14-9-5-8-13(20)16(14)21/h2-10H,1H3,(H2,22,23,26)