ethyl 2-(2-phenylsulfanylethanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-phenylsulfanylethanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-isopropylphenyl)-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(phenylthio)ethyl]amino]-4-(4-propan-2-ylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-phenylsulfanylacetyl)amino]-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate Traditional Name: 4-p-cumenyl-2-[[2-(phenylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H25NO3S2 MolecularWeight: 439.5902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C(C)C)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C(C)C)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C24H25NO3S2/c1-4-28-24(27)22-20(18-12-10-17(11-13-18)16(2)3)14-30-23(22)25-21(26)15-29-19-8-6-5-7-9-19/h5-14,16H,4,15H2,1-3H3,(H,25,26)