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

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=CC=C4Cl

InChI

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