N-(5-methoxy-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-2,4-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C23H28N3O3S+ MolecularWeight: 426.55172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N(CC[NH+]2CCOCC2)C3=NC4=C(S3)C=CC(=C4)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N(CC[NH+]2CCOCC2)C3=NC4=C(S3)C=CC(=C4)OC)C

InChI

InChI=1S/C23H27N3O3S/c1-16-4-6-19(17(2)14-16)22(27)26(9-8-25-10-12-29-13-11-25)23-24-20-15-18(28-3)5-7-21(20)30-23/h4-7,14-15H,8-13H2,1-3H3/p+1