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

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-4-methylsulfanyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-methylsulfanyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-(methylthio)-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-methylsulfanyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-(methylthio)-N-(2-pyridylmethyl)benzamide Formula: C22H18ClN3OS2 MolecularWeight: 439.98082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)SC)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)SC)Cl

InChI

InChI=1S/C22H18ClN3OS2/c1-14-18(23)10-11-19-20(14)25-22(29-19)26(13-16-5-3-4-12-24-16)21(27)15-6-8-17(28-2)9-7-15/h3-12H,13H2,1-2H3