3-(2-azanylethyl)-4-phenethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2-azanylethyl)-4-phenethyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-aminoethyl)-4-phenethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-aminoethyl)-4-phenethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-aminoethyl)-4-phenethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-aminoethyl)-4-phenethyl-1H-1,2,4-triazole-5-thione Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NNC2=S)CCN

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NNC2=S)CCN

InChI

InChI=1S/C12H16N4S/c13-8-6-11-14-15-12(17)16(11)9-7-10-4-2-1-3-5-10/h1-5H,6-9,13H2,(H,15,17)