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

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-2-methylsulfanyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-methylsulfanyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(methylthio)-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-methylsulfanyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(methylthio)-N-(2-pyridylmethyl)benzamide Formula: C21H16ClN3OS2 MolecularWeight: 425.95424

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=CC=C4Cl

InChI

InChI=1S/C21H16ClN3OS2/c1-27-17-10-3-2-8-15(17)20(26)25(13-14-7-4-5-12-23-14)21-24-19-16(22)9-6-11-18(19)28-21/h2-12H,13H2,1H3