2-morpholin-4-ylcarbonyl-N-(2-propan-2-ylsulfanyl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 2-morpholin-4-ylcarbonyl-N-(2-propan-2-ylsulfanyl-1,3-benzothiazol-6-yl)benzamide Openeye Name: N-(2-isopropylsulfanyl-1,3-benzothiazol-6-yl)-2-(morpholine-4-carbonyl)benzamide CAS Name: 2-[4-morpholinyl(oxo)methyl]-N-[2-(propan-2-ylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 2-(morpholine-4-carbonyl)-N-(2-propan-2-ylsulfanyl-1,3-benzothiazol-6-yl)benzamide Traditional Name: N-[2-(isopropylthio)-1,3-benzothiazol-6-yl]-2-(morpholine-4-carbonyl)benzamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)N4CCOCC4

Isomeric SMILES

CC(C)SC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)N4CCOCC4

InChI

InChI=1S/C22H23N3O3S2/c1-14(2)29-22-24-18-8-7-15(13-19(18)30-22)23-20(26)16-5-3-4-6-17(16)21(27)25-9-11-28-12-10-25/h3-8,13-14H,9-12H2,1-2H3,(H,23,26)