N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-2-morpholin-4-ium-4-yl-acetamide Formula: C20H22N3O3S+ MolecularWeight: 384.47198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C[NH+]4CCOCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C[NH+]4CCOCC4

InChI

InChI=1S/C20H21N3O3S/c1-25-16-6-7-17-18(12-16)27-20(22-17)14-2-4-15(5-3-14)21-19(24)13-23-8-10-26-11-9-23/h2-7,12H,8-11,13H2,1H3,(H,21,24)/p+1