ethyl 4-[[5-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)-2H-indazol-3-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)-2H-indazol-3-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[5-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)-2H-indazol-3-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[5-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)-2H-indazol-3-yl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)-2H-indazol-3-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[5-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)-2H-indazol-3-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H27N7O2 MolecularWeight: 445.51688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=C3C=C(C=CC3=NN2)C4C(=C(NC(=C4C#N)C)C)C#N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=C3C=C(C=CC3=NN2)C4C(=C(NC(=C4C#N)C)C)C#N

InChI

InChI=1S/C24H27N7O2/c1-4-33-24(32)31-9-7-30(8-10-31)14-22-18-11-17(5-6-21(18)28-29-22)23-19(12-25)15(2)27-16(3)20(23)13-26/h5-6,11,23,27H,4,7-10,14H2,1-3H3,(H,28,29)