1-(4-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate

Systemtic Name: 1-(4-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate Openeye Name: 1-(4-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate CAS Name: 1-(4-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate IUPAC Name: 1-(4-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate Traditional Name: 1-(4-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate Formula: C16H12ClN2S- MolecularWeight: 299.79788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(C(=C2C1)C#N)[S-])C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC2=C(N=C(C(=C2C1)C#N)[S-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2S/c17-11-7-5-10(6-8-11)15-13-4-2-1-3-12(13)14(9-18)16(20)19-15/h5-8H,1-4H2,(H,19,20)/p-1