4-[butyl(methyl)sulfamoyl]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-[butyl(methyl)sulfamoyl]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-[butyl(methyl)sulfamoyl]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-[butyl(methyl)sulfamoyl]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-[butyl(methyl)sulfamoyl]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-[butyl(methyl)sulfamoyl]-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H22N4O5S2/c1-4-5-12-22(2)31(28,29)16-9-6-14(7-10-16)19(25)21-20-23(3)17-13-15(24(26)27)8-11-18(17)30-20/h6-11,13H,4-5,12H2,1-3H3