1-(4-methylphenyl)-N-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]cyclohexane-1-carboxamide

Systemtic Name: 1-(4-methylphenyl)-N-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]cyclohexane-1-carboxamide Openeye Name: 1-(p-tolyl)-N-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]cyclohexanecarboxamide CAS Name: 1-(4-methylphenyl)-N-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]-1-cyclohexanecarboxamide IUPAC Name: 1-(4-methylphenyl)-N-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]cyclohexane-1-carboxamide Traditional Name: 1-(p-tolyl)-N-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]cyclohexanecarboxamide Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCCCC2)C(=O)NCCC3=NC(=NN3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2(CCCCC2)C(=O)NCCC3=NC(=NN3)C4=CC=NC=C4

InChI

InChI=1S/C23H27N5O/c1-17-5-7-19(8-6-17)23(12-3-2-4-13-23)22(29)25-16-11-20-26-21(28-27-20)18-9-14-24-15-10-18/h5-10,14-15H,2-4,11-13,16H2,1H3,(H,25,29)(H,26,27,28)