[6-chloranyl-2-oxidanylidene-4-phenyl-1-(phenylmethyl)quinolin-3-yl] piperidine-1-carbodithioate

Systemtic Name: [6-chloranyl-2-oxidanylidene-4-phenyl-1-(phenylmethyl)quinolin-3-yl] piperidine-1-carbodithioate Openeye Name: (1-benzyl-6-chloro-2-oxo-4-phenyl-3-quinolyl) piperidine-1-carbodithioate CAS Name: 1-piperidinecarbodithioic acid [6-chloro-2-oxo-4-phenyl-1-(phenylmethyl)-3-quinolinyl] ester IUPAC Name: (1-benzyl-6-chloro-2-oxo-4-phenylquinolin-3-yl) piperidine-1-carbodithioate Traditional Name: piperidine-1-carbodithioic acid (1-benzyl-6-chloro-2-keto-4-phenyl-3-quinolyl) ester Formula: C28H25ClN2OS2 MolecularWeight: 505.0939

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)SC2=C(C3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=S)SC2=C(C3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H25ClN2OS2/c29-22-14-15-24-23(18-22)25(21-12-6-2-7-13-21)26(34-28(33)30-16-8-3-9-17-30)27(32)31(24)19-20-10-4-1-5-11-20/h1-2,4-7,10-15,18H,3,8-9,16-17,19H2