N-[[2-(dimethylamino)pyridin-4-yl]methyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-4-yl]methyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-[[2-(dimethylamino)-4-pyridyl]methyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-[[2-(dimethylamino)-4-pyridinyl]methyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[[2-(dimethylamino)pyridin-4-yl]methyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-[[2-(dimethylamino)-4-pyridyl]methyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C22H23N5O5S MolecularWeight: 469.51352

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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)NCC3=CC(=NC=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)NCC3=CC(=NC=C3)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O5S/c1-15-4-9-19(13-20(15)27(29)30)33(31,32)25-18-7-5-17(6-8-18)22(28)24-14-16-10-11-23-21(12-16)26(2)3/h4-13,25H,14H2,1-3H3,(H,24,28)