N-(1-adamantylmethyl)-2-[[4-azanyl-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[[4-azanyl-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(1-adamantylmethyl)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantylmethyl)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C23H37N5OS MolecularWeight: 431.63778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2=NN=C(N2N)SCC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCC(CC1)CCC2=NN=C(N2N)SCC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H37N5OS/c24-28-20(7-6-16-4-2-1-3-5-16)26-27-22(28)30-14-21(29)25-15-23-11-17-8-18(12-23)10-19(9-17)13-23/h16-19H,1-15,24H2,(H,25,29)