3-butyl-4-(4-nitrophenyl)-N-phenyl-1,3-thiazol-3-ium-2-amine

Systemtic Name: 3-butyl-4-(4-nitrophenyl)-N-phenyl-1,3-thiazol-3-ium-2-amine Openeye Name: 3-butyl-4-(4-nitrophenyl)-N-phenyl-thiazol-3-ium-2-amine CAS Name: 3-butyl-4-(4-nitrophenyl)-N-phenyl-2-thiazol-3-iumamine IUPAC Name: 3-butyl-4-(4-nitrophenyl)-N-phenyl-1,3-thiazol-3-ium-2-amine Traditional Name: [3-butyl-4-(4-nitrophenyl)thiazol-3-ium-2-yl]-phenyl-amine Formula: C19H20N3O2S+ MolecularWeight: 354.446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(SC=C1C2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=CC=C3

Isomeric SMILES

CCCC[N+]1=C(SC=C1C2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2S/c1-2-3-13-21-18(15-9-11-17(12-10-15)22(23)24)14-25-19(21)20-16-7-5-4-6-8-16/h4-12,14H,2-3,13H2,1H3/p+1