N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-3-nitro-benzenesulfonamide CAS Name: N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-3-nitrobenzenesulfonamide IUPAC Name: N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[1-(3,4-dichlorobenzyl)-1,2,4-triazol-3-yl]-3-nitro-benzenesulfonamide Formula: C15H11Cl2N5O4S MolecularWeight: 428.24994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=NN(C=N2)CC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=NN(C=N2)CC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11Cl2N5O4S/c16-13-5-4-10(6-14(13)17)8-21-9-18-15(19-21)20-27(25,26)12-3-1-2-11(7-12)22(23)24/h1-7,9H,8H2,(H,19,20)