N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-propan-2-ylsulfanyl-benzamide

Systemtic Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-propan-2-ylsulfanyl-benzamide Openeye Name: 3-isopropylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)benzamide CAS Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-3-(propan-2-ylthio)benzamide IUPAC Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-propan-2-ylsulfanylbenzamide Traditional Name: 3-(isopropylthio)-N-(4-mesyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)benzamide Formula: C24H29N3O4S3 MolecularWeight: 519.69976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC(=C1)C(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

Isomeric SMILES

CC(C)SC1=CC=CC(=C1)C(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

InChI

InChI=1S/C24H29N3O4S3/c1-17(2)32-19-7-4-6-18(16-19)23(28)27(11-10-26-12-14-31-15-13-26)24-25-22-20(33-24)8-5-9-21(22)34(3,29)30/h4-9,16-17H,10-15H2,1-3H3