4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 4-[(3,5-dimethyl-1-piperidyl)sulfonyl]-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)benzamide CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 4-(3,5-dimethylpiperidino)sulfonyl-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-N-(2-morpholinoethyl)benzamide Formula: C28H36N4O4S3 MolecularWeight: 588.80484

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN3CCOCC3)C4=NC5=C(S4)C=CC=C5SC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN3CCOCC3)C4=NC5=C(S4)C=CC=C5SC)C

InChI

InChI=1S/C28H36N4O4S3/c1-20-17-21(2)19-31(18-20)39(34,35)23-9-7-22(8-10-23)27(33)32(12-11-30-13-15-36-16-14-30)28-29-26-24(37-3)5-4-6-25(26)38-28/h4-10,20-21H,11-19H2,1-3H3