N-(1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-benzylsulfanyl-N-(3-pyridylmethyl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(phenylmethylthio)-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-benzylsulfanyl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(benzylthio)-N-(3-pyridylmethyl)acetamide Formula: C22H19N3OS2 MolecularWeight: 405.53576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)N(CC2=CN=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)N(CC2=CN=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H19N3OS2/c26-21(16-27-15-17-7-2-1-3-8-17)25(14-18-9-6-12-23-13-18)22-24-19-10-4-5-11-20(19)28-22/h1-13H,14-16H2