N-(4-chloranyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(2-pyridylmethyl)acetamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(phenylthio)-N-(2-pyridinylmethyl)acetamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-2-ylmethyl)acetamide Traditional Name: N-(4-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=CC=C4Cl

Isomeric SMILES

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

InChI

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