N-(2-methylpropyl)-1-[(3S)-1-pent-4-enoylpiperidin-3-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-methylpropyl)-1-[(3S)-1-pent-4-enoylpiperidin-3-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-isobutyl-1-[(3S)-1-pent-4-enoyl-3-piperidyl]triazole-4-carboxamide CAS Name: N-(2-methylpropyl)-1-[(3S)-1-(1-oxopent-4-enyl)-3-piperidinyl]-4-triazolecarboxamide IUPAC Name: N-(2-methylpropyl)-1-[(3S)-1-pent-4-enoylpiperidin-3-yl]triazole-4-carboxamide Traditional Name: N-isobutyl-1-[(3S)-1-pent-4-enoyl-3-piperidyl]triazole-4-carboxamide Formula: C17H27N5O2 MolecularWeight: 333.42858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN(N=N1)C2CCCN(C2)C(=O)CCC=C

Isomeric SMILES

CC(C)CNC(=O)C1=CN(N=N1)[C@H]2CCCN(C2)C(=O)CCC=C

InChI

InChI=1S/C17H27N5O2/c1-4-5-8-16(23)21-9-6-7-14(11-21)22-12-15(19-20-22)17(24)18-10-13(2)3/h4,12-14H,1,5-11H2,2-3H3,(H,18,24)/t14-/m0/s1