methyl 1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]-3-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: methyl 1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]-3-(phenylmethyl)piperidine-3-carboxylate Openeye Name: methyl 3-benzyl-1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]piperidine-3-carboxylate CAS Name: 1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]-3-(phenylmethyl)-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 3-benzyl-1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]piperidine-3-carboxylate Traditional Name: 3-benzyl-1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]nipecotic acid methyl ester Formula: C25H26N6O2 MolecularWeight: 442.51294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC2=NN1)C3=NC(=CN=N3)N4CCCC(C4)(CC5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC1=C2C=C(C=CC2=NN1)C3=NC(=CN=N3)N4CCCC(C4)(CC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C25H26N6O2/c1-17-20-13-19(9-10-21(20)29-28-17)23-27-22(15-26-30-23)31-12-6-11-25(16-31,24(32)33-2)14-18-7-4-3-5-8-18/h3-5,7-10,13,15H,6,11-12,14,16H2,1-2H3,(H,28,29)