8-[3-(phenylmethylsulfanyl)phenyl]-6-propan-2-yl-quinoline

Systemtic Name: 8-[3-(phenylmethylsulfanyl)phenyl]-6-propan-2-yl-quinoline Openeye Name: 8-(3-benzylsulfanylphenyl)-6-isopropyl-quinoline CAS Name: 8-[3-(phenylmethylthio)phenyl]-6-propan-2-ylquinoline IUPAC Name: 8-(3-benzylsulfanylphenyl)-6-propan-2-ylquinoline Traditional Name: 8-[3-(benzylthio)phenyl]-6-isopropyl-quinoline Formula: C25H23NS MolecularWeight: 369.52182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)SCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C25H23NS/c1-18(2)22-14-21-11-7-13-26-25(21)24(16-22)20-10-6-12-23(15-20)27-17-19-8-4-3-5-9-19/h3-16,18H,17H2,1-2H3