ethyl 3-[2-(2,5-dimethylphenyl)sulfanylethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-(2,5-dimethylphenyl)sulfanylethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(2,5-dimethylphenyl)sulfanylacetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[(2,5-dimethylphenyl)thio]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2,5-dimethylphenyl)sulfanylacetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[(2,5-dimethylphenyl)thio]acetyl]amino]-5-phenyl-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)CSC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CSC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H23NO3S2/c1-4-27-23(26)22-18(13-20(29-22)17-8-6-5-7-9-17)24-21(25)14-28-19-12-15(2)10-11-16(19)3/h5-13H,4,14H2,1-3H3,(H,24,25)