4-chloranyl-3-[3-(phenylmethylsulfanyl)quinolin-4-yl]sulfanyl-quinoline

Systemtic Name: 4-chloranyl-3-[3-(phenylmethylsulfanyl)quinolin-4-yl]sulfanyl-quinoline Openeye Name: 3-benzylsulfanyl-4-[(4-chloro-3-quinolyl)sulfanyl]quinoline CAS Name: 4-chloro-3-[[3-(phenylmethylthio)-4-quinolinyl]thio]quinoline IUPAC Name: 3-benzylsulfanyl-4-(4-chloroquinolin-3-yl)sulfanylquinoline Traditional Name: 3-(benzylthio)-4-[(4-chloro-3-quinolyl)thio]quinoline Formula: C25H17ClN2S2 MolecularWeight: 444.99888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C3=CC=CC=C3N=C2)SC4=C(C5=CC=CC=C5N=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C3=CC=CC=C3N=C2)SC4=C(C5=CC=CC=C5N=C4)Cl

InChI

InChI=1S/C25H17ClN2S2/c26-24-18-10-4-6-12-20(18)27-14-22(24)30-25-19-11-5-7-13-21(19)28-15-23(25)29-16-17-8-2-1-3-9-17/h1-15H,16H2