3-[2-[(2Z)-2-octylidenehydrazinyl]-1,3-thiazol-4-yl]chromen-2-one bromide

Systemtic Name: 3-[2-[(2Z)-2-octylidenehydrazinyl]-1,3-thiazol-4-yl]chromen-2-one bromide Openeye Name: 3-[2-[(2Z)-2-octylidenehydrazino]thiazol-4-yl]chromen-2-one bromide CAS Name: 3-[2-[(2Z)-2-octylidenehydrazinyl]-4-thiazolyl]-1-benzopyran-2-one bromide IUPAC Name: 3-[2-[(2Z)-2-octylidenehydrazinyl]-1,3-thiazol-4-yl]chromen-2-one bromide Traditional Name: 3-[2-[(N'Z)-N'-octylidenehydrazino]thiazol-4-yl]coumarin bromide Formula: C20H23BrN3O2S- MolecularWeight: 449.38452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=NNC1=NC(=CS1)C2=CC3=CC=CC=C3OC2=O.[Br-]

Isomeric SMILES

CCCCCCC/C=N\NC1=NC(=CS1)C2=CC3=CC=CC=C3OC2=O.[Br-]

InChI

InChI=1S/C20H23N3O2S.BrH/c1-2-3-4-5-6-9-12-21-23-20-22-17(14-26-20)16-13-15-10-7-8-11-18(15)25-19(16)24;/h7-8,10-14H,2-6,9H2,1H3,(H,22,23);1H/p-1/b21-12-;