4-chloranyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-chloranyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-chloro-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)benzamide CAS Name: 4-chloro-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-chloro-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-chloro-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)benzamide Formula: C22H18ClN3OS MolecularWeight: 407.91582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H18ClN3OS/c1-14-5-10-19-20(15(14)2)25-22(28-19)26(13-16-4-3-11-24-12-16)21(27)17-6-8-18(23)9-7-17/h3-12H,13H2,1-2H3