[5-(3-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-1-yl]-(3-propylcyclohexyl)methanone

Systemtic Name: [5-(3-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-1-yl]-(3-propylcyclohexyl)methanone Openeye Name: [5-(3-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-1-yl]-(3-propylcyclohexyl)methanone CAS Name: [5-(3-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-1-yl]-(3-propylcyclohexyl)methanone IUPAC Name: [5-(3-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-1-yl]-(3-propylcyclohexyl)methanone Traditional Name: [5-(3-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-1-yl]-(3-propylcyclohexyl)methanone Formula: C18H26N4O MolecularWeight: 314.42524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCCC(C1)C(=O)N2C(=NC=N2)C3=C(CNC=C3)C

Isomeric SMILES

CCCC1CCCC(C1)C(=O)N2C(=NC=N2)C3=C(CNC=C3)C

InChI

InChI=1S/C18H26N4O/c1-3-5-14-6-4-7-15(10-14)18(23)22-17(20-12-21-22)16-8-9-19-11-13(16)2/h8-9,12,14-15,19H,3-7,10-11H2,1-2H3