5-azanyl-3-methylsulfanyl-N-(1-phenylethyl)-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-3-methylsulfanyl-N-(1-phenylethyl)-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-3-methylsulfanyl-N-(1-phenylethyl)-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-3-(methylthio)-N-(1-phenylethyl)-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-3-methylsulfanyl-N-(1-phenylethyl)-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-3-(methylthio)-N-(1-phenylethyl)-1,2,4-triazole-1-carbothioamide Formula: C12H15N5S2 MolecularWeight: 293.411

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)N2C(=NC(=N2)SC)N

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=S)N2C(=NC(=N2)SC)N

InChI

InChI=1S/C12H15N5S2/c1-8(9-6-4-3-5-7-9)14-12(18)17-10(13)15-11(16-17)19-2/h3-8H,1-2H3,(H,14,18)(H2,13,15,16)