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

Systemtic Name: tert-butyl N-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]carbamate Openeye Name: tert-butyl N-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]carbamate CAS Name: N-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]carbamate Traditional Name: N-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]carbamic acid tert-butyl ester Formula: C8H15N5O2S MolecularWeight: 245.302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=NNC(=S)N1N

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=NNC(=S)N1N

InChI

InChI=1S/C8H15N5O2S/c1-8(2,3)15-7(14)10-4-5-11-12-6(16)13(5)9/h4,9H2,1-3H3,(H,10,14)(H,12,16)