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

Systemtic Name: N-(1-adamantylmethyl)-2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(1-adamantylmethyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1-adamantylmethyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C19H31N5OS MolecularWeight: 377.54734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(N1N)SCC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)(C)C1=NN=C(N1N)SCC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H31N5OS/c1-18(2,3)16-22-23-17(24(16)20)26-10-15(25)21-11-19-7-12-4-13(8-19)6-14(5-12)9-19/h12-14H,4-11,20H2,1-3H3,(H,21,25)