diethyl 1-(4-fluorophenyl)carbonylsulfanyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 1-(4-fluorophenyl)carbonylsulfanyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 1-(4-fluorobenzoyl)sulfanyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-[[(4-fluorophenyl)-oxomethyl]thio]-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(4-fluorobenzoyl)sulfanyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-[(4-fluorobenzoyl)thio]-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C26H25FN2O7S MolecularWeight: 528.549303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)SC(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)SC(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C26H25FN2O7S/c1-5-35-24(30)21-15(3)28(37-26(32)17-10-12-19(27)13-11-17)16(4)22(25(31)36-6-2)23(21)18-8-7-9-20(14-18)29(33)34/h7-14,23H,5-6H2,1-4H3