N-(2-methyl-1,3-benzoxazol-5-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide

Systemtic Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C22H18N4O6S MolecularWeight: 466.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O6S/c1-13-3-9-18(12-20(13)26(28)29)33(30,31)25-16-6-4-15(5-7-16)22(27)24-17-8-10-21-19(11-17)23-14(2)32-21/h3-12,25H,1-2H3,(H,24,27)