2-[4-bromanyl-2-[(Z)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-bromanyl-2-[(Z)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenoxy]ethanenitrile Openeye Name: 2-[2-[(Z)-(2-anilino-4-oxo-thiazol-5-ylidene)methyl]-4-bromo-phenoxy]acetonitrile CAS Name: 2-[2-[(Z)-(2-anilino-4-oxo-5-thiazolylidene)methyl]-4-bromophenoxy]acetonitrile IUPAC Name: 2-[2-[(Z)-(2-anilino-4-oxo-1,3-thiazol-5-ylidene)methyl]-4-bromophenoxy]acetonitrile Traditional Name: 2-[2-[(Z)-(2-anilino-4-keto-2-thiazolin-5-ylidene)methyl]-4-bromo-phenoxy]acetonitrile Formula: C18H12BrN3O2S MolecularWeight: 414.27578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=O)C(=CC3=C(C=CC(=C3)Br)OCC#N)S2

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=O)/C(=C/C3=C(C=CC(=C3)Br)OCC#N)/S2

InChI

InChI=1S/C18H12BrN3O2S/c19-13-6-7-15(24-9-8-20)12(10-13)11-16-17(23)22-18(25-16)21-14-4-2-1-3-5-14/h1-7,10-11H,9H2,(H,21,22,23)/b16-11-