N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(4-mesyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-3-nitro-4-piperidino-benzamide Formula: C26H31N5O6S2 MolecularWeight: 573.68424

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C26H31N5O6S2/c1-39(35,36)23-7-5-6-22-24(23)27-26(38-22)30(13-12-28-14-16-37-17-15-28)25(32)19-8-9-20(21(18-19)31(33)34)29-10-3-2-4-11-29/h5-9,18H,2-4,10-17H2,1H3