N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]ethyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]ethyl]-3,4-dimethyl-benzamide Openeye Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]ethyl]-3,4-dimethyl-benzamide CAS Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-piperazin-1-iumyl]ethyl]-3,4-dimethylbenzamide IUPAC Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]ethyl]-3,4-dimethylbenzamide Traditional Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-ium-1-yl]ethyl]-3,4-dimethyl-benzamide Formula: C24H31N4OS+ MolecularWeight: 423.59414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC[NH+]2CCN(CC2)C3=NC4=C(S3)C=CC(=C4C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC[NH+]2CCN(CC2)C3=NC4=C(S3)C=CC(=C4C)C)C

InChI

InChI=1S/C24H30N4OS/c1-16-5-7-20(15-18(16)3)23(29)25-9-10-27-11-13-28(14-12-27)24-26-22-19(4)17(2)6-8-21(22)30-24/h5-8,15H,9-14H2,1-4H3,(H,25,29)/p+1