N-[6-(dimethylamino)pyridin-3-yl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide

Systemtic Name: N-[6-(dimethylamino)pyridin-3-yl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-[6-(dimethylamino)-3-pyridyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-[6-(dimethylamino)-3-pyridinyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[6-(dimethylamino)pyridin-3-yl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-[6-(dimethylamino)-3-pyridyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C21H21N5O5S MolecularWeight: 455.48694

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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=CN=C(C=C3)N(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O5S/c1-14-4-10-18(12-19(14)26(28)29)32(30,31)24-16-7-5-15(6-8-16)21(27)23-17-9-11-20(22-13-17)25(2)3/h4-13,24H,1-3H3,(H,23,27)