N-[4-(1-adamantyl)phenyl]-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C32H38N4OS MolecularWeight: 526.73532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

InChI

InChI=1S/C32H38N4OS/c37-29(33-27-13-11-26(12-14-27)32-18-22-15-23(19-32)17-24(16-22)20-32)21-38-31-35-34-30(25-7-3-1-4-8-25)36(31)28-9-5-2-6-10-28/h1,3-4,7-8,11-14,22-24,28H,2,5-6,9-10,15-21H2,(H,33,37)