N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-1,3-thiazol-2-amine hydrobromide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-1,3-thiazol-2-amine hydrobromide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)thiazol-2-amine hydrobromide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-2-thiazolamine hydrobromide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-1,3-thiazol-2-amine hydrobromide Traditional Name: homoveratryl-[4-(3-nitrophenyl)thiazol-2-yl]amine hydrobromide Formula: C19H20BrN3O4S MolecularWeight: 466.3488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])OC.Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])OC.Br

InChI

InChI=1S/C19H19N3O4S.BrH/c1-25-17-7-6-13(10-18(17)26-2)8-9-20-19-21-16(12-27-19)14-4-3-5-15(11-14)22(23)24;/h3-7,10-12H,8-9H2,1-2H3,(H,20,21);1H