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

Systemtic Name: bis(prop-2-enyl) (4R)-2,6-dimethyl-4-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diallyl (4R)-2,6-dimethyl-4-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4R)-2,6-dimethyl-4-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-3,4-dihydropyridine-3,5-dicarboxylic acid bis(prop-2-enyl) ester IUPAC Name: bis(prop-2-enyl) (4R)-2,6-dimethyl-4-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4R)-2,6-dimethyl-4-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-3,4-dihydropyridine-3,5-dicarboxylic acid diallyl ester Formula: C28H27N3O4S MolecularWeight: 501.59668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OCC=C)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)OCC=C)C

Isomeric SMILES

CC1=NC(=C([C@H](C1C(=O)OCC=C)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)OCC=C)C

InChI

InChI=1S/C28H27N3O4S/c1-5-14-34-27(32)23-18(3)29-19(4)24(28(33)35-15-6-2)25(23)21-17-31(20-11-8-7-9-12-20)30-26(21)22-13-10-16-36-22/h5-13,16-17,23,25H,1-2,14-15H2,3-4H3/t23?,25-/m0/s1