N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]-N-[2-(4-morpholinyl)ethyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]-N-(2-morpholinoethyl)-4-piperidinosulfonyl-benzamide Formula: C26H32N4O4S3 MolecularWeight: 560.75168

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C26H32N4O4S3/c1-35-21-7-10-23-24(19-21)36-26(27-23)30(14-13-28-15-17-34-18-16-28)25(31)20-5-8-22(9-6-20)37(32,33)29-11-3-2-4-12-29/h5-10,19H,2-4,11-18H2,1H3