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

Systemtic Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-morpholin-4-yl-N-(2-morpholin-4-ylethyl)-3-nitro-benzamide Openeye Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-morpholino-N-(2-morpholinoethyl)-3-nitro-benzamide CAS Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-(4-morpholinyl)-N-[2-(4-morpholinyl)ethyl]-3-nitrobenzamide IUPAC Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-morpholin-4-yl-N-(2-morpholin-4-ylethyl)-3-nitrobenzamide Traditional Name: N-(4-mesyl-1,3-benzothiazol-2-yl)-4-morpholino-N-(2-morpholinoethyl)-3-nitro-benzamide Formula: C25H29N5O7S2 MolecularWeight: 575.65706

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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)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C25H29N5O7S2/c1-39(34,35)22-4-2-3-21-23(22)26-25(38-21)29(8-7-27-9-13-36-14-10-27)24(31)18-5-6-19(20(17-18)30(32)33)28-11-15-37-16-12-28/h2-6,17H,7-16H2,1H3