4-[[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]amino]methyl]-3-nitro-benzamide

Systemtic Name: 4-[[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]amino]methyl]-3-nitro-benzamide Openeye Name: 4-[[5-(dimethylsulfamoyl)-2-(ethylamino)anilino]methyl]-3-nitro-benzamide CAS Name: 4-[[5-(dimethylsulfamoyl)-2-(ethylamino)anilino]methyl]-3-nitrobenzamide IUPAC Name: 4-[[5-(dimethylsulfamoyl)-2-(ethylamino)anilino]methyl]-3-nitrobenzamide Traditional Name: 4-[[5-(dimethylsulfamoyl)-2-(ethylamino)anilino]methyl]-3-nitro-benzamide Formula: C18H23N5O5S MolecularWeight: 421.47072

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O5S/c1-4-20-15-8-7-14(29(27,28)22(2)3)10-16(15)21-11-13-6-5-12(18(19)24)9-17(13)23(25)26/h5-10,20-21H,4,11H2,1-3H3,(H2,19,24)