5-azanyl-N-(phenylmethyl)-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-N-(phenylmethyl)-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-N-benzyl-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-N-(phenylmethyl)-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-N-benzyl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-N-benzyl-1,2,4-triazole-1-carbothioamide Formula: C10H11N5S MolecularWeight: 233.29284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)N2C(=NC=N2)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N2C(=NC=N2)N

InChI

InChI=1S/C10H11N5S/c11-9-13-7-14-15(9)10(16)12-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,16)(H2,11,13,14)