5-azanyl-3-[(E)-dimethylaminomethylideneamino]-N-methyl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-3-[(E)-dimethylaminomethylideneamino]-N-methyl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-3-[(E)-dimethylaminomethyleneamino]-N-methyl-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-3-[(E)-dimethylaminomethylideneamino]-N-methyl-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-3-[(E)-dimethylaminomethylideneamino]-N-methyl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-3-[(E)-dimethylaminomethyleneamino]-N-methyl-1,2,4-triazole-1-carbothioamide Formula: C7H13N7S MolecularWeight: 227.29002

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(=NC(=N1)N=CN(C)C)N

Isomeric SMILES

CNC(=S)N1C(=NC(=N1)/N=C/N(C)C)N

InChI

InChI=1S/C7H13N7S/c1-9-7(15)14-5(8)11-6(12-14)10-4-13(2)3/h4H,1-3H3,(H,9,15)(H2,8,11,12)/b10-4+