2-(2-methylphenoxy)-N-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: 2-(2-methylphenoxy)-N-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,3-benzothiazol-6-yl]ethanamide Openeye Name: 2-(2-methylphenoxy)-N-[2-(2-morpholino-2-oxo-ethyl)sulfanyl-1,3-benzothiazol-6-yl]acetamide CAS Name: 2-(2-methylphenoxy)-N-[2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(2-methylphenoxy)-N-[2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-1,3-benzothiazol-6-yl]acetamide Traditional Name: N-[2-[(2-keto-2-morpholino-ethyl)thio]-1,3-benzothiazol-6-yl]-2-(2-methylphenoxy)acetamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)N4CCOCC4

InChI

InChI=1S/C22H23N3O4S2/c1-15-4-2-3-5-18(15)29-13-20(26)23-16-6-7-17-19(12-16)31-22(24-17)30-14-21(27)25-8-10-28-11-9-25/h2-7,12H,8-11,13-14H2,1H3,(H,23,26)