tert-butyl N-[1-(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-methyl-butyl]carbamate

Systemtic Name: tert-butyl N-[1-(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-methyl-butyl]carbamate Openeye Name: tert-butyl N-[1-(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)-2-methyl-butyl]carbamate CAS Name: N-[1-(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-methylbutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-methylbutyl]carbamate Traditional Name: N-[1-(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)-2-methyl-butyl]carbamic acid tert-butyl ester Formula: C12H23N5O2S MolecularWeight: 301.40832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=NNC(=S)N1N)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)C(C1=NNC(=S)N1N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C12H23N5O2S/c1-6-7(2)8(9-15-16-10(20)17(9)13)14-11(18)19-12(3,4)5/h7-8H,6,13H2,1-5H3,(H,14,18)(H,16,20)