bis(2-methoxyethyl) 2,6-dimethyl-4-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: bis(2-methoxyethyl) 2,6-dimethyl-4-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: bis(2-methoxyethyl) 2,6-dimethyl-4-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-1,4-dihydropyridine-3,5-dicarboxylic acid bis(2-methoxyethyl) ester IUPAC Name: bis(2-methoxyethyl) 2,6-dimethyl-4-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylic acid bis(2-methoxyethyl) ester Formula: C28H31N3O6S MolecularWeight: 537.62724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCOC)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCOC)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)OCCOC

InChI

InChI=1S/C28H31N3O6S/c1-18-23(27(32)36-14-12-34-3)25(24(19(2)29-18)28(33)37-15-13-35-4)21-17-31(20-9-6-5-7-10-20)30-26(21)22-11-8-16-38-22/h5-11,16-17,25,29H,12-15H2,1-4H3