N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-(phenylmethylthio)-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-benzylsulfanyl-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-(benzylthio)-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide Formula: C23H20ClN3OS2 MolecularWeight: 454.0074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CC=N3)C(=O)CSCC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CC=N3)C(=O)CSCC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H20ClN3OS2/c1-16-19(24)10-11-20-22(16)26-23(30-20)27(13-18-9-5-6-12-25-18)21(28)15-29-14-17-7-3-2-4-8-17/h2-12H,13-15H2,1H3