3-[[5-(4-tert-butylphenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide

Systemtic Name: 3-[[5-(4-tert-butylphenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide Openeye Name: 3-[[5-(4-tert-butylphenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide CAS Name: 3-[[5-(4-tert-butylphenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]-N-(methylcarbamoyl)propanamide IUPAC Name: 3-[[5-(4-tert-butylphenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide Traditional Name: 3-[[5-(4-tert-butylphenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]-N-(methylcarbamoyl)propionamide Formula: C23H33N5O2S MolecularWeight: 443.60542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCCC(=O)NC(=O)NC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCCC(=O)NC(=O)NC

InChI

InChI=1S/C23H33N5O2S/c1-23(2,3)17-12-10-16(11-13-17)20-26-27-22(28(20)18-8-6-5-7-9-18)31-15-14-19(29)25-21(30)24-4/h10-13,18H,5-9,14-15H2,1-4H3,(H2,24,25,29,30)