N-[4-[3-[(3,4-dimethoxyphenyl)methyl-methyl-amino]propylsulfanyl]phenyl]-4-oxidanylidene-2-phenyl-1H-quinoline-8-carboxamide

Systemtic Name: N-[4-[3-[(3,4-dimethoxyphenyl)methyl-methyl-amino]propylsulfanyl]phenyl]-4-oxidanylidene-2-phenyl-1H-quinoline-8-carboxamide Openeye Name: N-[4-[3-[(3,4-dimethoxyphenyl)methyl-methyl-amino]propylsulfanyl]phenyl]-4-oxo-2-phenyl-1H-quinoline-8-carboxamide CAS Name: N-[4-[3-[(3,4-dimethoxyphenyl)methyl-methylamino]propylthio]phenyl]-4-oxo-2-phenyl-1H-quinoline-8-carboxamide IUPAC Name: N-[4-[3-[(3,4-dimethoxyphenyl)methyl-methylamino]propylsulfanyl]phenyl]-4-oxo-2-phenyl-1H-quinoline-8-carboxamide Traditional Name: 4-keto-N-[4-[3-[methyl(veratryl)amino]propylthio]phenyl]-2-phenyl-1H-quinoline-8-carboxamide Formula: C35H35N3O4S MolecularWeight: 593.7351

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCSC1=CC=C(C=C1)NC(=O)C2=CC=CC3=C2NC(=CC3=O)C4=CC=CC=C4)CC5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CN(CCCSC1=CC=C(C=C1)NC(=O)C2=CC=CC3=C2NC(=CC3=O)C4=CC=CC=C4)CC5=CC(=C(C=C5)OC)OC

InChI

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