(phenylmethyl) 4-[1-(5-oxidanylidene-3-phenyl-2H-1,2,4-triazin-6-yl)propylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[1-(5-oxidanylidene-3-phenyl-2H-1,2,4-triazin-6-yl)propylcarbamoyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[1-(5-oxo-3-phenyl-2H-1,2,4-triazin-6-yl)propylcarbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[1-(5-oxo-3-phenyl-2H-1,2,4-triazin-6-yl)propylamino]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[1-(5-oxo-3-phenyl-2H-1,2,4-triazin-6-yl)propylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[1-(5-keto-3-phenyl-2H-1,2,4-triazin-6-yl)propylcarbamoyl]piperidine-1-carboxylic acid benzyl ester Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NNC(=NC1=O)C2=CC=CC=C2)NC(=O)C3CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCC(C1=NNC(=NC1=O)C2=CC=CC=C2)NC(=O)C3CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29N5O4/c1-2-21(22-25(33)28-23(30-29-22)19-11-7-4-8-12-19)27-24(32)20-13-15-31(16-14-20)26(34)35-17-18-9-5-3-6-10-18/h3-12,20-21H,2,13-17H2,1H3,(H,27,32)(H,28,30,33)