ethyl 5-phenyl-3-(4-phenylsulfanylbutanoylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 5-phenyl-3-(4-phenylsulfanylbutanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 5-phenyl-3-(4-phenylsulfanylbutanoylamino)thiophene-2-carboxylate CAS Name: 3-[[1-oxo-4-(phenylthio)butyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-3-(4-phenylsulfanylbutanoylamino)thiophene-2-carboxylate Traditional Name: 5-phenyl-3-[4-(phenylthio)butanoylamino]thiophene-2-carboxylic acid ethyl ester Formula: C23H23NO3S2 MolecularWeight: 425.56362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C23H23NO3S2/c1-2-27-23(26)22-19(16-20(29-22)17-10-5-3-6-11-17)24-21(25)14-9-15-28-18-12-7-4-8-13-18/h3-8,10-13,16H,2,9,14-15H2,1H3,(H,24,25)