1-(3-chlorophenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-(3-chlorophenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,2,3,4-tetrazole-5-thione Openeye Name: 1-(3-chlorophenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)tetrazole-5-thione CAS Name: 1-(3-chlorophenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-tetrazolethione IUPAC Name: 1-(3-chlorophenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)tetrazole-5-thione Traditional Name: 1-(3-chlorophenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)tetrazole-5-thione Formula: C17H16ClN5S MolecularWeight: 357.86044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN5S/c18-15-6-3-7-16(10-15)23-17(24)22(19-20-23)12-21-9-8-13-4-1-2-5-14(13)11-21/h1-7,10H,8-9,11-12H2