3-[(phenylmethyl)amino]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(phenylmethyl)amino]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-(benzylamino)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(phenylmethyl)amino]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(benzylamino)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-(benzylamino)-1H-1,2,4-triazole-5-thione Formula: C12H14N4S MolecularWeight: 246.33136

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=S)NN=C1NCC2=CC=CC=C2

Isomeric SMILES

C=CCN1C(=S)NN=C1NCC2=CC=CC=C2

InChI

InChI=1S/C12H14N4S/c1-2-8-16-11(14-15-12(16)17)13-9-10-6-4-3-5-7-10/h2-7H,1,8-9H2,(H,13,14)(H,15,17)