N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(p-tolylsulfanyl)-N-(3-pyridylmethyl)acetamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(4-methylphenyl)thio]-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(p-tolylthio)-N-(3-pyridylmethyl)acetamide Formula: C23H21N3OS2 MolecularWeight: 419.56234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)N(CC2=CN=CC=C2)C3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N(CC2=CN=CC=C2)C3=NC4=C(S3)C=C(C=C4)C

InChI

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