2-[[4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-chloranyl-6-ethoxy-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-chloranyl-6-ethoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]-2-chloro-6-ethoxy-phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[(2-amino-4-oxo-5-thiazolylidene)methyl]-2-chloro-6-ethoxyphenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-chloro-6-ethoxyphenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-2-chloro-6-ethoxy-phenoxy]methyl]benzonitrile Formula: C20H16ClN3O3S MolecularWeight: 413.87734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)N)Cl)OCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)N)Cl)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H16ClN3O3S/c1-2-26-16-8-12(9-17-19(25)24-20(23)28-17)7-15(21)18(16)27-11-14-6-4-3-5-13(14)10-22/h3-9H,2,11H2,1H3,(H2,23,24,25)