ethyl 2-[2-[4-(4-chlorophenyl)-3-cyano-6-phenyl-pyridin-2-yl]sulfanylethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(4-chlorophenyl)-3-cyano-6-phenyl-pyridin-2-yl]sulfanylethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[[4-(4-chlorophenyl)-3-cyano-6-phenyl-2-pyridyl]sulfanyl]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[[4-(4-chlorophenyl)-3-cyano-6-phenyl-2-pyridinyl]thio]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(4-chlorophenyl)-3-cyano-6-phenylpyridin-2-yl]sulfanylacetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[[4-(4-chlorophenyl)-3-cyano-6-phenyl-2-pyridyl]thio]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C33H24ClN3O3S2 MolecularWeight: 610.14496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl)C#N

InChI

InChI=1S/C33H24ClN3O3S2/c1-2-40-33(39)30-27(21-9-5-3-6-10-21)19-41-32(30)37-29(38)20-42-31-26(18-35)25(22-13-15-24(34)16-14-22)17-28(36-31)23-11-7-4-8-12-23/h3-17,19H,2,20H2,1H3,(H,37,38)