N-(6-ethyl-1,3-benzothiazol-2-yl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C23H28N3O2S+ MolecularWeight: 410.55232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CC[NH+]3CCOCC3)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CC[NH+]3CCOCC3)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H27N3O2S/c1-3-18-6-9-20-21(16-18)29-23(24-20)26(11-10-25-12-14-28-15-13-25)22(27)19-7-4-17(2)5-8-19/h4-9,16H,3,10-15H2,1-2H3/p+1