4-[4-ethyl-5-(4-nitrophenyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-aniline

Systemtic Name: 4-[4-ethyl-5-(4-nitrophenyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-aniline Openeye Name: 4-[4-ethyl-5-(4-nitrophenyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-aniline CAS Name: 4-[4-ethyl-5-[(4-nitrophenyl)thio]-1,2,4-triazol-3-yl]-N,N-dimethylaniline IUPAC Name: 4-[4-ethyl-5-(4-nitrophenyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-dimethylaniline Traditional Name: [4-[4-ethyl-5-[(4-nitrophenyl)thio]-1,2,4-triazol-3-yl]phenyl]-dimethyl-amine Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCN1C(=NN=C1SC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C18H19N5O2S/c1-4-22-17(13-5-7-14(8-6-13)21(2)3)19-20-18(22)26-16-11-9-15(10-12-16)23(24)25/h5-12H,4H2,1-3H3