ethyl 2-[(4-chlorophenyl)carbamothioylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 2-[(4-chlorophenyl)carbamothioylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: ethyl 2-[(4-chlorophenyl)carbamothioylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[[(4-chloroanilino)-sulfanylidenemethyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chlorophenyl)carbamothioylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-[(4-chlorophenyl)thiocarbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C18H20ClN3O2S2 MolecularWeight: 409.9533

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H20ClN3O2S2/c1-3-24-17(23)15-13-8-9-22(2)10-14(13)26-16(15)21-18(25)20-12-6-4-11(19)5-7-12/h4-7H,3,8-10H2,1-2H3,(H2,20,21,25)