2-[2-bromanyl-6-methoxy-4-[[2-[(2-methylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-bromanyl-6-methoxy-4-[[2-[(2-methylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]phenoxy]ethanenitrile Openeye Name: 2-[2-bromo-6-methoxy-4-[[2-(2-methylanilino)-4-oxo-thiazol-5-ylidene]methyl]phenoxy]acetonitrile CAS Name: 2-[2-bromo-6-methoxy-4-[[2-(2-methylanilino)-4-oxo-5-thiazolylidene]methyl]phenoxy]acetonitrile IUPAC Name: 2-[2-bromo-6-methoxy-4-[[2-(2-methylanilino)-4-oxo-1,3-thiazol-5-ylidene]methyl]phenoxy]acetonitrile Traditional Name: 2-[2-bromo-4-[[4-keto-2-(o-toluidino)-2-thiazolin-5-ylidene]methyl]-6-methoxy-phenoxy]acetonitrile Formula: C20H16BrN3O3S MolecularWeight: 458.32834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=O)C(=CC3=CC(=C(C(=C3)Br)OCC#N)OC)S2

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=O)C(=CC3=CC(=C(C(=C3)Br)OCC#N)OC)S2

InChI

InChI=1S/C20H16BrN3O3S/c1-12-5-3-4-6-15(12)23-20-24-19(25)17(28-20)11-13-9-14(21)18(27-8-7-22)16(10-13)26-2/h3-6,9-11H,8H2,1-2H3,(H,23,24,25)