N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(2-pyridylmethyl)acetamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(phenylthio)-N-(2-pyridinylmethyl)acetamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-2-ylmethyl)acetamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(phenylthio)-N-(2-pyridylmethyl)acetamide Formula: C21H16ClN3OS2 MolecularWeight: 425.95424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C21H16ClN3OS2/c22-15-9-10-18-19(12-15)28-21(24-18)25(13-16-6-4-5-11-23-16)20(26)14-27-17-7-2-1-3-8-17/h1-12H,13-14H2