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

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C19H30N6O2S MolecularWeight: 406.5455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(N1N)SCC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)(C)C1=NN=C(N1N)SCC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H30N6O2S/c1-18(2,3)15-23-24-17(25(15)20)28-10-14(26)21-16(27)22-19-7-11-4-12(8-19)6-13(5-11)9-19/h11-13H,4-10,20H2,1-3H3,(H2,21,22,26,27)