4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-(2,6-dimethylmorpholino)sulfonyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C21H23N3O4S3 MolecularWeight: 477.62002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)SC

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)SC

InChI

InChI=1S/C21H23N3O4S3/c1-13-11-24(12-14(2)28-13)31(26,27)17-7-4-15(5-8-17)20(25)23-21-22-18-9-6-16(29-3)10-19(18)30-21/h4-10,13-14H,11-12H2,1-3H3,(H,22,23,25)