N-cyclopentyl-2-[[4-(2-ethylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclopentyl-2-[[4-(2-ethylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-cyclopentyl-2-[[4-(2-ethylphenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-cyclopentyl-2-[[4-(2-ethylphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cyclopentyl-2-[[4-(2-ethylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-cyclopentyl-2-[[4-(2-ethylphenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=NN=C2SCC(=O)NC3CCCC3)C4=CN=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1N2C(=NN=C2SCC(=O)NC3CCCC3)C4=CN=CC=C4

InChI

InChI=1S/C22H25N5OS/c1-2-16-8-3-6-12-19(16)27-21(17-9-7-13-23-14-17)25-26-22(27)29-15-20(28)24-18-10-4-5-11-18/h3,6-9,12-14,18H,2,4-5,10-11,15H2,1H3,(H,24,28)