methyl 2-[5,6-dimethyl-2-(4-morpholin-4-yl-3-nitro-phenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[5,6-dimethyl-2-(4-morpholin-4-yl-3-nitro-phenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[5,6-dimethyl-2-(4-morpholino-3-nitro-benzoyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[5,6-dimethyl-2-[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[5,6-dimethyl-2-(4-morpholin-4-yl-3-nitrobenzoyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[5,6-dimethyl-2-(4-morpholino-3-nitro-benzoyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C23H24N4O6S MolecularWeight: 484.52486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])N2CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])N2CC(=O)OC

InChI

InChI=1S/C23H24N4O6S/c1-14-10-19-20(11-15(14)2)34-23(26(19)13-21(28)32-3)24-22(29)16-4-5-17(18(12-16)27(30)31)25-6-8-33-9-7-25/h4-5,10-12H,6-9,13H2,1-3H3