N-(4-chloranyl-1,3-benzothiazol-2-yl)-4-cyano-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-4-cyano-N-(pyridin-3-ylmethyl)benzamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(3-pyridylmethyl)benzamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(3-pyridinylmethyl)benzamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(pyridin-3-ylmethyl)benzamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(3-pyridylmethyl)benzamide Formula: C21H13ClN4OS MolecularWeight: 404.87212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)N=C(S2)N(CC3=CN=CC=C3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)N=C(S2)N(CC3=CN=CC=C3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H13ClN4OS/c22-17-4-1-5-18-19(17)25-21(28-18)26(13-15-3-2-10-24-12-15)20(27)16-8-6-14(11-23)7-9-16/h1-10,12H,13H2