N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-[(4-methylphenyl)sulfonylamino]benzamide

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-[(4-methylphenyl)sulfonylamino]benzamide Openeye Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(p-tolylsulfonylamino)benzamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-[(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-[(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(tosylamino)benzamide Formula: C22H18N4O6S2 MolecularWeight: 498.53152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=NC4=C(C=C(C=C4S3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=NC4=C(C=C(C=C4S3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H18N4O6S2/c1-13-7-9-15(10-8-13)34(30,31)25-17-6-4-3-5-16(17)21(27)24-22-23-20-18(32-2)11-14(26(28)29)12-19(20)33-22/h3-12,25H,1-2H3,(H,23,24,27)