3-[[5-(2-chloranyl-4-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methoxy]-N,N-dimethyl-aniline

Systemtic Name: 3-[[5-(2-chloranyl-4-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methoxy]-N,N-dimethyl-aniline Openeye Name: 3-[[5-(2-chloro-4-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methoxy]-N,N-dimethyl-aniline CAS Name: 3-[[5-[(2-chloro-4-nitrophenyl)thio]-4-phenyl-1,2,4-triazol-3-yl]methoxy]-N,N-dimethylaniline IUPAC Name: 3-[[5-(2-chloro-4-nitrophenyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methoxy]-N,N-dimethylaniline Traditional Name: [3-[[5-[(2-chloro-4-nitro-phenyl)thio]-4-phenyl-1,2,4-triazol-3-yl]methoxy]phenyl]-dimethyl-amine Formula: C23H20ClN5O3S MolecularWeight: 481.9546

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=CC=C1)OCC2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CN(C)C1=CC(=CC=C1)OCC2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H20ClN5O3S/c1-27(2)17-9-6-10-19(13-17)32-15-22-25-26-23(28(22)16-7-4-3-5-8-16)33-21-12-11-18(29(30)31)14-20(21)24/h3-14H,15H2,1-2H3