N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylsulfanylphenyl)-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylsulfanylphenyl)-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-(4-isopropylsulfanylphenyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide CAS Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-2-[4-(propan-2-ylthio)phenyl]-N-(2-pyridinylmethyl)acetamide IUPAC Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylsulfanylphenyl)-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[4-(isopropylthio)phenyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide Formula: C25H25N3O2S2 MolecularWeight: 463.6149

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)N(CC2=CC=CC=N2)C3=NC4=C(C=CC=C4S3)OC

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)N(CC2=CC=CC=N2)C3=NC4=C(C=CC=C4S3)OC

InChI

InChI=1S/C25H25N3O2S2/c1-17(2)31-20-12-10-18(11-13-20)15-23(29)28(16-19-7-4-5-14-26-19)25-27-24-21(30-3)8-6-9-22(24)32-25/h4-14,17H,15-16H2,1-3H3