N-(4-methoxy-3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(4-methoxy-3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(4-methoxy-3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-morpholinosulfonyl-benzamide CAS Name: N-(4-methoxy-3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(4-methoxy-3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(4-methoxy-3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-morpholinosulfonyl-benzamide Formula: C20H20N4O7S2 MolecularWeight: 492.5254

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-])OC

Isomeric SMILES

CN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-])OC

InChI

InChI=1S/C20H20N4O7S2/c1-22-18-16(30-2)11-14(24(26)27)12-17(18)32-20(22)21-19(25)13-3-5-15(6-4-13)33(28,29)23-7-9-31-10-8-23/h3-6,11-12H,7-10H2,1-2H3