phenethyl 6-methyl-4-(3-nitrophenyl)-3-phenyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: phenethyl 6-methyl-4-(3-nitrophenyl)-3-phenyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate Openeye Name: phenethyl 6-methyl-4-(3-nitrophenyl)-3-phenyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate CAS Name: 6-methyl-4-(3-nitrophenyl)-3-phenyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid phenethyl ester IUPAC Name: phenethyl 6-methyl-4-(3-nitrophenyl)-3-phenyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate Traditional Name: 6-methyl-4-(3-nitrophenyl)-3-phenyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid phenethyl ester Formula: C29H24N2O4S MolecularWeight: 496.57686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)SC=C2C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(C2=C(N1)SC=C2C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OCCC5=CC=CC=C5

InChI

InChI=1S/C29H24N2O4S/c1-19-25(29(32)35-16-15-20-9-4-2-5-10-20)26(22-13-8-14-23(17-22)31(33)34)27-24(18-36-28(27)30-19)21-11-6-3-7-12-21/h2-14,17-18,26,30H,15-16H2,1H3