N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-morpholin-4-ylsulfonyl-2-oxidanyl-benzamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-morpholin-4-ylsulfonyl-2-oxidanyl-benzamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-hydroxy-5-morpholinosulfonyl-benzamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-hydroxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-hydroxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-hydroxy-5-morpholinosulfonyl-benzamide Formula: C20H21N3O5S2 MolecularWeight: 447.52784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)O)C

InChI

InChI=1S/C20H21N3O5S2/c1-12-9-13(2)18-17(10-12)29-20(21-18)22-19(25)15-11-14(3-4-16(15)24)30(26,27)23-5-7-28-8-6-23/h3-4,9-11,24H,5-8H2,1-2H3,(H,21,22,25)