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

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-2-(p-tolylsulfanyl)-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-2-(p-tolylthio)-N-(3-pyridylmethyl)acetamide Formula: C25H25N3OS2 MolecularWeight: 447.6155

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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(C=CC=C4S3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=CC=C4S3)C(C)C

InChI

InChI=1S/C25H25N3OS2/c1-17(2)21-7-4-8-22-24(21)27-25(31-22)28(15-19-6-5-13-26-14-19)23(29)16-30-20-11-9-18(3)10-12-20/h4-14,17H,15-16H2,1-3H3