ethyl 2-[4-[[4-(4-methylsulfanylphenyl)thiophen-2-yl]carbonylamino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[[4-(4-methylsulfanylphenyl)thiophen-2-yl]carbonylamino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[[4-(4-methylsulfanylphenyl)thiophene-2-carbonyl]amino]phenyl]acetate CAS Name: 2-[4-[[[4-[4-(methylthio)phenyl]-2-thiophenyl]-oxomethyl]amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[4-(4-methylsulfanylphenyl)thiophene-2-carbonyl]amino]phenyl]acetate Traditional Name: 2-[4-[[4-[4-(methylthio)phenyl]thiophene-2-carbonyl]amino]phenyl]acetic acid ethyl ester Formula: C22H21NO3S2 MolecularWeight: 411.53704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)NC(=O)C2=CC(=CS2)C3=CC=C(C=C3)SC

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)NC(=O)C2=CC(=CS2)C3=CC=C(C=C3)SC

InChI

InChI=1S/C22H21NO3S2/c1-3-26-21(24)12-15-4-8-18(9-5-15)23-22(25)20-13-17(14-28-20)16-6-10-19(27-2)11-7-16/h4-11,13-14H,3,12H2,1-2H3,(H,23,25)