4-[[4-(2-methylcyclohexyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-propan-2-yl-1,3-thiazole

Systemtic Name: 4-[[4-(2-methylcyclohexyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-propan-2-yl-1,3-thiazole Openeye Name: 2-isopropyl-4-[[4-(2-methylcyclohexyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole CAS Name: 4-[[[4-(2-methylcyclohexyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-2-propan-2-ylthiazole IUPAC Name: 4-[[4-(2-methylcyclohexyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-propan-2-yl-1,3-thiazole Traditional Name: 2-isopropyl-4-[[[4-(2-methylcyclohexyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole Formula: C21H27N5S2 MolecularWeight: 413.60258

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2C(=NN=C2SCC3=CSC(=N3)C(C)C)C4=CN=CC=C4

Isomeric SMILES

CC1CCCCC1N2C(=NN=C2SCC3=CSC(=N3)C(C)C)C4=CN=CC=C4

InChI

InChI=1S/C21H27N5S2/c1-14(2)20-23-17(12-27-20)13-28-21-25-24-19(16-8-6-10-22-11-16)26(21)18-9-5-4-7-15(18)3/h6,8,10-12,14-15,18H,4-5,7,9,13H2,1-3H3