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

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C18H18N6O5S MolecularWeight: 430.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O5S/c1-12-4-6-14(30(28,29)22(2)3)9-15(12)21-18(25)13-5-7-16(17(8-13)24(26)27)23-11-19-10-20-23/h4-11H,1-3H3,(H,21,25)