N-(5-methyl-2-phenyl-pyrazol-3-yl)-2-[[4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-methyl-2-phenyl-pyrazol-3-yl)-2-[[4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-benzyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: N-(5-methyl-2-phenyl-3-pyrazolyl)-2-[[4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(4-benzyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[[4-benzyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C26H23N7OS MolecularWeight: 481.57212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H23N7OS/c1-19-16-23(33(31-19)22-10-6-3-7-11-22)28-24(34)18-35-26-30-29-25(21-12-14-27-15-13-21)32(26)17-20-8-4-2-5-9-20/h2-16H,17-18H2,1H3,(H,28,34)