N-cyclohexyl-2-[[5,7-dimethyl-6-(phenylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclohexyl-2-[[5,7-dimethyl-6-(phenylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[(6-benzyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-cyclohexyl-acetamide CAS Name: N-cyclohexyl-2-[[5,7-dimethyl-6-(phenylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thio]acetamide IUPAC Name: 2-[(6-benzyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-cyclohexylacetamide Traditional Name: 2-[(6-benzyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio]-N-cyclohexyl-acetamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=NC(=NN12)SCC(=O)NC3CCCCC3)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NC2=NC(=NN12)SCC(=O)NC3CCCCC3)C)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N5OS/c1-15-19(13-17-9-5-3-6-10-17)16(2)27-21(23-15)25-22(26-27)29-14-20(28)24-18-11-7-4-8-12-18/h3,5-6,9-10,18H,4,7-8,11-14H2,1-2H3,(H,24,28)