2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-(5-methyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[[4-cyclohexyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C25H28N6OS2 MolecularWeight: 492.65942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)CC4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)CC4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C25H28N6OS2/c1-18-15-22(31(29-18)20-11-6-3-7-12-20)26-24(32)17-34-25-28-27-23(16-21-13-8-14-33-21)30(25)19-9-4-2-5-10-19/h3,6-8,11-15,19H,2,4-5,9-10,16-17H2,1H3,(H,26,32)