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

Systemtic Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(3-pyridylmethyl)acetamide CAS Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-2-(phenylthio)-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-2-(phenylthio)-N-(3-pyridylmethyl)acetamide Formula: C23H21N3OS2 MolecularWeight: 419.56234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C23H21N3OS2/c1-2-18-9-6-12-20-22(18)25-23(29-20)26(15-17-8-7-13-24-14-17)21(27)16-28-19-10-4-3-5-11-19/h3-14H,2,15-16H2,1H3