N-[2-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[2-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[2-(4-prop-2-ynyl-1-piperazinyl)phenyl]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[2-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-[2-(4-propargylpiperazino)phenyl]-2-(8-quinolylthio)acetamide Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCN(CC1)C2=CC=CC=C2NC(=O)CSC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C#CCN1CCN(CC1)C2=CC=CC=C2NC(=O)CSC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C24H24N4OS/c1-2-13-27-14-16-28(17-15-27)21-10-4-3-9-20(21)26-23(29)18-30-22-11-5-7-19-8-6-12-25-24(19)22/h1,3-12H,13-18H2,(H,26,29)