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

Systemtic Name: ethyl 2-[4-(4-methylphenyl)sulfanylbutanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[4-(p-tolylsulfanyl)butanoylamino]thiophene-3-carboxylate CAS Name: 2-[[4-[(4-methylphenyl)thio]-1-oxobutyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-methylphenyl)sulfanylbutanoylamino]thiophene-3-carboxylate Traditional Name: 2-[4-(p-tolylthio)butanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C18H21NO3S2 MolecularWeight: 363.49424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO3S2/c1-3-22-18(21)15-10-12-24-17(15)19-16(20)5-4-11-23-14-8-6-13(2)7-9-14/h6-10,12H,3-5,11H2,1-2H3,(H,19,20)