(E)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-quinolin-8-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-quinolin-8-yl-prop-2-enamide Openeye Name: (E)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(8-quinolyl)prop-2-enamide CAS Name: (E)-N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-(8-quinolinyl)-2-propenamide IUPAC Name: (E)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-quinolin-8-ylprop-2-enamide Traditional Name: (E)-N-[2-[(2-cyanobenzyl)thio]ethyl]-3-(8-quinolyl)acrylamide Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C=CC2=CC=CC3=C2N=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)/C=C/C2=CC=CC3=C2N=CC=C3)C#N

InChI

InChI=1S/C22H19N3OS/c23-15-19-5-1-2-6-20(19)16-27-14-13-24-21(26)11-10-18-8-3-7-17-9-4-12-25-22(17)18/h1-12H,13-14,16H2,(H,24,26)/b11-10+