ethyl 2-[4-(4-chlorophenyl)sulfanylbutanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[4-(4-chlorophenyl)sulfanylbutanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[4-(4-chlorophenyl)sulfanylbutanoylamino]thiophene-3-carboxylate CAS Name: 2-[[4-[(4-chlorophenyl)thio]-1-oxobutyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-chlorophenyl)sulfanylbutanoylamino]thiophene-3-carboxylate Traditional Name: 2-[4-[(4-chlorophenyl)thio]butanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C17H18ClNO3S2 MolecularWeight: 383.91272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H18ClNO3S2/c1-2-22-17(21)14-9-11-24-16(14)19-15(20)4-3-10-23-13-7-5-12(18)6-8-13/h5-9,11H,2-4,10H2,1H3,(H,19,20)