2-[2-bromanyl-4-[(4-oxidanylidene-2-phenylimino-3-propan-2-yl-1,3-thiazolidin-5-ylidene)methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-bromanyl-4-[(4-oxidanylidene-2-phenylimino-3-propan-2-yl-1,3-thiazolidin-5-ylidene)methyl]phenoxy]ethanenitrile Openeye Name: 2-[2-bromo-4-[(3-isopropyl-4-oxo-2-phenylimino-thiazolidin-5-ylidene)methyl]phenoxy]acetonitrile CAS Name: 2-[2-bromo-4-[(4-oxo-2-phenylimino-3-propan-2-yl-5-thiazolidinylidene)methyl]phenoxy]acetonitrile IUPAC Name: 2-[2-bromo-4-[(4-oxo-2-phenylimino-3-propan-2-yl-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetonitrile Traditional Name: 2-[2-bromo-4-[(3-isopropyl-4-keto-2-phenylimino-thiazolidin-5-ylidene)methyl]phenoxy]acetonitrile Formula: C21H18BrN3O2S MolecularWeight: 456.35552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(=CC2=CC(=C(C=C2)OCC#N)Br)SC1=NC3=CC=CC=C3

Isomeric SMILES

CC(C)N1C(=O)C(=CC2=CC(=C(C=C2)OCC#N)Br)SC1=NC3=CC=CC=C3

InChI

InChI=1S/C21H18BrN3O2S/c1-14(2)25-20(26)19(28-21(25)24-16-6-4-3-5-7-16)13-15-8-9-18(17(22)12-15)27-11-10-23/h3-9,12-14H,11H2,1-2H3