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

Systemtic Name: methyl 3-(cyclohexylmethyl)-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate Openeye Name: methyl 3-(cyclohexylmethyl)-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate CAS Name: 3-(cyclohexylmethyl)-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(cyclohexylmethyl)-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate Traditional Name: 3-(cyclohexylmethyl)-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid methyl ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)SC=C2CC3CCCCC3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)SC=C2CC3CCCCC3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C23H26N2O4S/c1-14-19(23(26)29-2)20(16-9-6-10-18(12-16)25(27)28)21-17(13-30-22(21)24-14)11-15-7-4-3-5-8-15/h6,9-10,12-13,15,20,24H,3-5,7-8,11H2,1-2H3