N-(3-oxidanylpropyl)-1-[1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-oxidanylpropyl)-1-[1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-hydroxypropyl)-1-[1-[(4-isopropylphenyl)methyl]-3-piperidyl]triazole-4-carboxamide CAS Name: N-(3-hydroxypropyl)-1-[1-[(4-propan-2-ylphenyl)methyl]-3-piperidinyl]-4-triazolecarboxamide IUPAC Name: N-(3-hydroxypropyl)-1-[1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]triazole-4-carboxamide Traditional Name: N-(3-hydroxypropyl)-1-[1-(4-isopropylbenzyl)-3-piperidyl]triazole-4-carboxamide Formula: C21H31N5O2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCCC(C2)N3C=C(N=N3)C(=O)NCCCO

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCCC(C2)N3C=C(N=N3)C(=O)NCCCO

InChI

InChI=1S/C21H31N5O2/c1-16(2)18-8-6-17(7-9-18)13-25-11-3-5-19(14-25)26-15-20(23-24-26)21(28)22-10-4-12-27/h6-9,15-16,19,27H,3-5,10-14H2,1-2H3,(H,22,28)