2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-fluorophenyl)-1,2,4-triazole-3-thione CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-fluorophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-fluorophenyl)-1,2,4-triazole-3-thione Formula: C21H21FN4S MolecularWeight: 380.481643

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN(C1=S)CN2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)F

Isomeric SMILES

C=CCN1C(=NN(C1=S)CN2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4S/c1-2-12-25-20(17-7-9-19(22)10-8-17)23-26(21(25)27)15-24-13-11-16-5-3-4-6-18(16)14-24/h2-10H,1,11-15H2