1-[2-(4-ethylpiperazin-1-yl)phenyl]sulfanylisoquinoline

Systemtic Name: 1-[2-(4-ethylpiperazin-1-yl)phenyl]sulfanylisoquinoline Openeye Name: 1-[2-(4-ethylpiperazin-1-yl)phenyl]sulfanylisoquinoline CAS Name: 1-[[2-(4-ethyl-1-piperazinyl)phenyl]thio]isoquinoline IUPAC Name: 1-[2-(4-ethylpiperazin-1-yl)phenyl]sulfanylisoquinoline Traditional Name: 1-[[2-(4-ethylpiperazino)phenyl]thio]isoquinoline Formula: C21H23N3S MolecularWeight: 349.49242

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=CC=C2SC3=NC=CC4=CC=CC=C43

Isomeric SMILES

CCN1CCN(CC1)C2=CC=CC=C2SC3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C21H23N3S/c1-2-23-13-15-24(16-14-23)19-9-5-6-10-20(19)25-21-18-8-4-3-7-17(18)11-12-22-21/h3-12H,2,13-16H2,1H3