N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(4-ethoxyphenyl)-N-phenyl-1,3-thiazol-2-amine hydrobromide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(4-ethoxyphenyl)-N-phenyl-1,3-thiazol-2-amine hydrobromide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-4-(4-ethoxyphenyl)-N-phenyl-thiazol-2-amine hydrobromide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(4-ethoxyphenyl)-N-phenyl-2-thiazolamine hydrobromide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(4-ethoxyphenyl)-N-phenyl-1,3-thiazol-2-amine hydrobromide Traditional Name: phenyl-[(E)-piperonylideneamino]-(4-p-phenetylthiazol-2-yl)amine hydrobromide Formula: C25H22BrN3O3S MolecularWeight: 524.42948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)N(C3=CC=CC=C3)N=CC4=CC5=C(C=C4)OCO5.Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)N(C3=CC=CC=C3)/N=C/C4=CC5=C(C=C4)OCO5.Br

InChI

InChI=1S/C25H21N3O3S.BrH/c1-2-29-21-11-9-19(10-12-21)22-16-32-25(27-22)28(20-6-4-3-5-7-20)26-15-18-8-13-23-24(14-18)31-17-30-23;/h3-16H,2,17H2,1H3;1H/b26-15+;