1-[4-chloranyl-3-(1,3-dithian-2-yl)-5-phenyl-phenyl]-4-ethyl-piperazine

Systemtic Name: 1-[4-chloranyl-3-(1,3-dithian-2-yl)-5-phenyl-phenyl]-4-ethyl-piperazine Openeye Name: 1-[4-chloro-3-(1,3-dithian-2-yl)-5-phenyl-phenyl]-4-ethyl-piperazine CAS Name: 1-[4-chloro-3-(1,3-dithian-2-yl)-5-phenylphenyl]-4-ethylpiperazine IUPAC Name: 1-[4-chloro-3-(1,3-dithian-2-yl)-5-phenylphenyl]-4-ethylpiperazine Traditional Name: 1-[4-chloro-3-(1,3-dithian-2-yl)-5-phenyl-phenyl]-4-ethyl-piperazine Formula: C22H27ClN2S2 MolecularWeight: 419.04618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3)Cl)C4SCCCS4

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3)Cl)C4SCCCS4

InChI

InChI=1S/C22H27ClN2S2/c1-2-24-9-11-25(12-10-24)18-15-19(17-7-4-3-5-8-17)21(23)20(16-18)22-26-13-6-14-27-22/h3-5,7-8,15-16,22H,2,6,9-14H2,1H3