3-cyano-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]benzamide

Systemtic Name: 3-cyano-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]benzamide Openeye Name: 3-cyano-N-[(2-phenylthiazol-4-yl)methyl]benzamide CAS Name: 3-cyano-N-[(2-phenyl-4-thiazolyl)methyl]benzamide IUPAC Name: 3-cyano-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]benzamide Traditional Name: 3-cyano-N-[(2-phenylthiazol-4-yl)methyl]benzamide Formula: C18H13N3OS MolecularWeight: 319.38032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CS2)CNC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CS2)CNC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H13N3OS/c19-10-13-5-4-8-15(9-13)17(22)20-11-16-12-23-18(21-16)14-6-2-1-3-7-14/h1-9,12H,11H2,(H,20,22)