methyl 4-(4-ethylphenyl)-5-methyl-2-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethylphenyl)-5-methyl-2-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethylphenyl)-5-methyl-2-[(2-phenyl-2-phenylsulfanyl-acetyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-5-methyl-2-[[1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethylphenyl)-5-methyl-2-[(2-phenyl-2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-5-methyl-2-[[2-phenyl-2-(phenylthio)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C29H27NO3S2 MolecularWeight: 501.65958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4)C

InChI

InChI=1S/C29H27NO3S2/c1-4-20-15-17-21(18-16-20)24-19(2)34-28(25(24)29(32)33-3)30-27(31)26(22-11-7-5-8-12-22)35-23-13-9-6-10-14-23/h5-18,26H,4H2,1-3H3,(H,30,31)