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

Systemtic Name: 4-[cyclopropyl(methyl)sulfamoyl]-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-[cyclopropyl(methyl)sulfamoyl]-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-[cyclopropyl(methyl)sulfamoyl]-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-[cyclopropyl(methyl)sulfamoyl]-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-[cyclopropyl(methyl)sulfamoyl]-N-(5-nitro-3-propargyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C21H18N4O5S2 MolecularWeight: 470.52142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=CC(=C4)[N+](=O)[O-])CC#C

Isomeric SMILES

CN(C1CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=CC(=C4)[N+](=O)[O-])CC#C

InChI

InChI=1S/C21H18N4O5S2/c1-3-12-24-18-13-16(25(27)28)8-11-19(18)31-21(24)22-20(26)14-4-9-17(10-5-14)32(29,30)23(2)15-6-7-15/h1,4-5,8-11,13,15H,6-7,12H2,2H3