2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-[(E)-styryl]-1H-1,2,4-triazole-3-thione CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-[(E)-styryl]-1H-1,2,4-triazole-3-thione Formula: C20H20N4S MolecularWeight: 348.4646

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CN3C(=S)N=C(N3)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CN3C(=S)N=C(N3)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C20H20N4S/c25-20-21-19(11-10-16-6-2-1-3-7-16)22-24(20)15-23-13-12-17-8-4-5-9-18(17)14-23/h1-11H,12-15H2,(H,21,22,25)/b11-10+