N-[(5-butylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)methyl]adamantane-1-carboxamide

Systemtic Name: N-[(5-butylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)methyl]adamantane-1-carboxamide Openeye Name: N-[(5-butylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)methyl]adamantane-1-carboxamide CAS Name: N-[[5-(butylthio)-4-ethyl-1,2,4-triazol-3-yl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[(5-butylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)methyl]adamantane-1-carboxamide Traditional Name: N-[[5-(butylthio)-4-ethyl-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide Formula: C20H32N4OS MolecularWeight: 376.55928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1CC)CNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCSC1=NN=C(N1CC)CNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H32N4OS/c1-3-5-6-26-19-23-22-17(24(19)4-2)13-21-18(25)20-10-14-7-15(11-20)9-16(8-14)12-20/h14-16H,3-13H2,1-2H3,(H,21,25)