2,3-dimethyl-5-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide

Systemtic Name: 2,3-dimethyl-5-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide Openeye Name: 2,3-dimethyl-5-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide CAS Name: 2,3-dimethyl-5-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide IUPAC Name: 2,3-dimethyl-5-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide Traditional Name: 2,3-dimethyl-5-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide Formula: C18H19N5O4S MolecularWeight: 401.43956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC(C)C2=CC=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NC(C)C2=CC=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O4S/c1-12-8-17(23(24)25)9-18(13(12)2)28(26,27)21-14(3)15-4-6-16(7-5-15)22-11-19-10-20-22/h4-11,14,21H,1-3H3