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

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C15H22N6O2S MolecularWeight: 350.43918

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=NNC(=N4)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=NNC(=N4)N

InChI

InChI=1S/C15H22N6O2S/c16-12-18-14(21-20-12)24-7-11(22)17-13(23)19-15-4-8-1-9(5-15)3-10(2-8)6-15/h8-10H,1-7H2,(H3,16,18,20,21)(H2,17,19,22,23)