O5-ethyl O3-(3-phenylprop-2-ynyl) 2-methyl-4-phenethyl-6-(4-thiophen-3-ylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-(3-phenylprop-2-ynyl) 2-methyl-4-phenethyl-6-(4-thiophen-3-ylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-(3-phenylprop-2-ynyl) 2-methyl-4-phenethyl-6-[4-(3-thienyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-4-phenethyl-6-[4-(3-thiophenyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-(3-phenylprop-2-ynyl) ester IUPAC Name: 5-O-ethyl 3-O-(3-phenylprop-2-ynyl) 2-methyl-4-phenethyl-6-(4-thiophen-3-ylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-methyl-4-phenethyl-6-[4-(3-thienyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-(3-phenylprop-2-ynyl) ester Formula: C37H33NO4S MolecularWeight: 587.72722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1CCC2=CC=CC=C2)C(=O)OCC#CC3=CC=CC=C3)C)C4=CC=C(C=C4)C5=CSC=C5

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1CCC2=CC=CC=C2)C(=O)OCC#CC3=CC=CC=C3)C)C4=CC=C(C=C4)C5=CSC=C5

InChI

InChI=1S/C37H33NO4S/c1-3-41-37(40)34-32(21-16-28-13-8-5-9-14-28)33(36(39)42-23-10-15-27-11-6-4-7-12-27)26(2)38-35(34)30-19-17-29(18-20-30)31-22-24-43-25-31/h4-9,11-14,17-20,22,24-25,32,38H,3,16,21,23H2,1-2H3