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

Systemtic Name: ethyl 3-[(2-ethylsulfanylphenyl)carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[(2-ethylsulfanylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[2-(ethylthio)phenyl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-ethylsulfanylbenzoyl)amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(ethylthio)benzoyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H21NO3S2 MolecularWeight: 411.53704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3SCC

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3SCC

InChI

InChI=1S/C22H21NO3S2/c1-3-26-22(25)20-17(14-19(28-20)15-10-6-5-7-11-15)23-21(24)16-12-8-9-13-18(16)27-4-2/h5-14H,3-4H2,1-2H3,(H,23,24)