5-azanyl-3-(4-cyanophenyl)sulfanyl-N-methyl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-3-(4-cyanophenyl)sulfanyl-N-methyl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-3-(4-cyanophenyl)sulfanyl-N-methyl-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-3-[(4-cyanophenyl)thio]-N-methyl-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-3-(4-cyanophenyl)sulfanyl-N-methyl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-3-[(4-cyanophenyl)thio]-N-methyl-1,2,4-triazole-1-carbothioamide Formula: C11H10N6S2 MolecularWeight: 290.3673

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(=NC(=N1)SC2=CC=C(C=C2)C#N)N

Isomeric SMILES

CNC(=S)N1C(=NC(=N1)SC2=CC=C(C=C2)C#N)N

InChI

InChI=1S/C11H10N6S2/c1-14-11(18)17-9(13)15-10(16-17)19-8-4-2-7(6-12)3-5-8/h2-5H,1H3,(H,14,18)(H2,13,15,16)