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

Systemtic Name: methyl 2-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-chloro-2-methyl-phenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chloro-2-methylphenyl)carbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(3-chloro-2-methyl-phenyl)thiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C15H15ClN2O2S2 MolecularWeight: 354.8748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2=C(C(=CC=C2)Cl)C)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2=C(C(=CC=C2)Cl)C)C(=O)OC

InChI

InChI=1S/C15H15ClN2O2S2/c1-8-7-10(14(19)20-3)13(22-8)18-15(21)17-12-6-4-5-11(16)9(12)2/h4-7H,1-3H3,(H2,17,18,21)