N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)pentanamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)pentanamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)pentanamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholin-4-iumyl)propyl]pentanamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)pentanamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)valeramide Formula: C20H29ClN3O2S+ MolecularWeight: 410.98116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CCC[NH+]1CCOCC1)C2=NC3=C(S2)C=C(C=C3C)Cl

Isomeric SMILES

CCCCC(=O)N(CCC[NH+]1CCOCC1)C2=NC3=C(S2)C=C(C=C3C)Cl

InChI

InChI=1S/C20H28ClN3O2S/c1-3-4-6-18(25)24(8-5-7-23-9-11-26-12-10-23)20-22-19-15(2)13-16(21)14-17(19)27-20/h13-14H,3-12H2,1-2H3/p+1