1-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propylsulfanyl]phenyl]-4-oxidanylidene-2-phenyl-quinoline-8-carboxamide

Systemtic Name: 1-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propylsulfanyl]phenyl]-4-oxidanylidene-2-phenyl-quinoline-8-carboxamide Openeye Name: 1-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propylsulfanyl]phenyl]-4-oxo-2-phenyl-quinoline-8-carboxamide CAS Name: 1-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propylthio]phenyl]-4-oxo-2-phenyl-8-quinolinecarboxamide IUPAC Name: 1-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propylsulfanyl]phenyl]-4-oxo-2-phenylquinoline-8-carboxamide Traditional Name: 1-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propylthio]phenyl]-4-keto-2-phenyl-quinoline-8-carboxamide Formula: C35H35N3O4S MolecularWeight: 593.7351

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)NCCCSC2=CC=C(C=C2)N3C(=CC(=O)C4=C3C(=CC=C4)C(=O)N)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)NCCCSC2=CC=C(C=C2)N3C(=CC(=O)C4=C3C(=CC=C4)C(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C35H35N3O4S/c1-23(25-13-18-32(41-2)33(21-25)42-3)37-19-8-20-43-27-16-14-26(15-17-27)38-30(24-9-5-4-6-10-24)22-31(39)28-11-7-12-29(34(28)38)35(36)40/h4-7,9-18,21-23,37H,8,19-20H2,1-3H3,(H2,36,40)