ethyl 2-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-chloro-5-methylsulfanyl-benzoyl)amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloro-5-methylsulfanylbenzoyl)amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-chloro-5-(methylthio)benzoyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H18ClNO3S2 MolecularWeight: 383.91272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=C(C=CC(=C2)SC)Cl)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=C(C=CC(=C2)SC)Cl)C(=O)OCC

InChI

InChI=1S/C17H18ClNO3S2/c1-4-10-8-13(17(21)22-5-2)16(24-10)19-15(20)12-9-11(23-3)6-7-14(12)18/h6-9H,4-5H2,1-3H3,(H,19,20)