2-[(E)-2-(4-methoxyphenyl)ethenyl]-8-oxidanyl-N-(2-phenylsulfanylethyl)quinoline-7-carboxamide

Systemtic Name: 2-[(E)-2-(4-methoxyphenyl)ethenyl]-8-oxidanyl-N-(2-phenylsulfanylethyl)quinoline-7-carboxamide Openeye Name: 8-hydroxy-2-[(E)-2-(4-methoxyphenyl)vinyl]-N-(2-phenylsulfanylethyl)quinoline-7-carboxamide CAS Name: 8-hydroxy-2-[(E)-2-(4-methoxyphenyl)ethenyl]-N-[2-(phenylthio)ethyl]-7-quinolinecarboxamide IUPAC Name: 8-hydroxy-2-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(2-phenylsulfanylethyl)quinoline-7-carboxamide Traditional Name: 8-hydroxy-2-[(E)-2-(4-methoxyphenyl)vinyl]-N-[2-(phenylthio)ethyl]quinoline-7-carboxamide Formula: C27H24N2O3S MolecularWeight: 456.55606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=NC3=C(C=C2)C=CC(=C3O)C(=O)NCCSC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=NC3=C(C=C2)C=CC(=C3O)C(=O)NCCSC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O3S/c1-32-22-14-8-19(9-15-22)7-12-21-13-10-20-11-16-24(26(30)25(20)29-21)27(31)28-17-18-33-23-5-3-2-4-6-23/h2-16,30H,17-18H2,1H3,(H,28,31)/b12-7+