1-(2-chlorophenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile

Systemtic Name: 1-(2-chlorophenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile Openeye Name: 1-(2-chlorophenyl)-3-thioxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile CAS Name: 1-(2-chlorophenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile IUPAC Name: 1-(2-chlorophenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile Traditional Name: 1-(2-chlorophenyl)-3-thioxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile Formula: C16H13ClN2S MolecularWeight: 300.80582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(NC(=S)C(=C2C1)C#N)C3=CC=CC=C3Cl

Isomeric SMILES

C1CCC2=C(NC(=S)C(=C2C1)C#N)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)