N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-(2-morpholinoethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-esyl-N-(2-morpholinoethyl)benzamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN2CCOCC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN2CCOCC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3O4S2/c1-2-31(27,28)20-10-6-3-7-17(20)21(26)25(12-11-24-13-15-29-16-14-24)22-23-18-8-4-5-9-19(18)30-22/h3-10H,2,11-16H2,1H3