5-[2-butylimino-3-[(Z)-(4-cyanophenyl)methylideneamino]-1,3-thiazol-4-yl]-2-oxidanyl-benzamide

Systemtic Name: 5-[2-butylimino-3-[(Z)-(4-cyanophenyl)methylideneamino]-1,3-thiazol-4-yl]-2-oxidanyl-benzamide Openeye Name: 5-[2-butylimino-3-[(Z)-(4-cyanophenyl)methyleneamino]thiazol-4-yl]-2-hydroxy-benzamide CAS Name: 5-[2-butylimino-3-[(Z)-(4-cyanophenyl)methylideneamino]-4-thiazolyl]-2-hydroxybenzamide IUPAC Name: 5-[2-butylimino-3-[(Z)-(4-cyanophenyl)methylideneamino]-1,3-thiazol-4-yl]-2-hydroxybenzamide Traditional Name: 5-[2-butylimino-3-[(Z)-(4-cyanobenzylidene)amino]-4-thiazolin-4-yl]-2-hydroxy-benzamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C1N(C(=CS1)C2=CC(=C(C=C2)O)C(=O)N)N=CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCN=C1N(C(=CS1)C2=CC(=C(C=C2)O)C(=O)N)/N=C\C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H21N5O2S/c1-2-3-10-25-22-27(26-13-16-6-4-15(12-23)5-7-16)19(14-30-22)17-8-9-20(28)18(11-17)21(24)29/h4-9,11,13-14,28H,2-3,10H2,1H3,(H2,24,29)/b25-22?,26-13-