4-(1,3-dithian-2-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]benzamide

Systemtic Name: 4-(1,3-dithian-2-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]benzamide Openeye Name: 4-(1,3-dithian-2-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]benzamide CAS Name: 4-(1,3-dithian-2-yl)-N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]benzamide IUPAC Name: 4-(1,3-dithian-2-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]benzamide Traditional Name: 4-(1,3-dithian-2-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]benzamide Formula: C24H32N3OS2+ MolecularWeight: 442.66038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)C4SCCCS4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)C4SCCCS4)C

InChI

InChI=1S/C24H31N3OS2/c1-3-26-11-13-27(14-12-26)21-9-10-22(18(2)17-21)25-23(28)19-5-7-20(8-6-19)24-29-15-4-16-30-24/h5-10,17,24H,3-4,11-16H2,1-2H3,(H,25,28)/p+1