1-(2-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate

Systemtic Name: 1-(2-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate Openeye Name: 1-(2-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate CAS Name: 1-(2-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate IUPAC Name: 1-(2-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinoline-3-thiolate Traditional Name: 1-(2-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=CC=C3Cl

Isomeric SMILES

C1CCC2=C(N=C(C(=C2C1)C#N)[S-])C3=CC=CC=C3Cl

InChI

InChI=1S/C16H13ClN2S/c17-14-8-4-3-7-12(14)15-11-6-2-1-5-10(11)13(9-18)16(20)19-15/h3-4,7-8H,1-2,5-6H2,(H,19,20)/p-1