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

Systemtic Name: 2-[4-[(Z)-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-5-bromanyl-2-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[4-[(Z)-(2-amino-4-oxo-thiazol-5-ylidene)methyl]-5-bromo-2-methoxy-phenoxy]acetonitrile CAS Name: 2-[4-[(Z)-(2-amino-4-oxo-5-thiazolylidene)methyl]-5-bromo-2-methoxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-5-bromo-2-methoxyphenoxy]acetonitrile Traditional Name: 2-[4-[(Z)-(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-5-bromo-2-methoxy-phenoxy]acetonitrile Formula: C13H10BrN3O3S MolecularWeight: 368.2058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C2C(=O)N=C(S2)N)Br)OCC#N

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C\2/C(=O)N=C(S2)N)Br)OCC#N

InChI

InChI=1S/C13H10BrN3O3S/c1-19-9-4-7(5-11-12(18)17-13(16)21-11)8(14)6-10(9)20-3-2-15/h4-6H,3H2,1H3,(H2,16,17,18)/b11-5-