N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(5-oxidanyl-1H-indol-3-yl)ethanamide

Systemtic Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(5-oxidanyl-1H-indol-3-yl)ethanamide Openeye Name: 2-(5-hydroxy-1H-indol-3-yl)-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide CAS Name: 2-(5-hydroxy-1H-indol-3-yl)-N-[2-[(2-methoxyphenyl)methylthio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(5-hydroxy-1H-indol-3-yl)-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide Traditional Name: 2-(5-hydroxy-1H-indol-3-yl)-N-[2-(o-anisylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C25H21N3O3S2 MolecularWeight: 475.58254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CC4=CNC5=C4C=C(C=C5)O

Isomeric SMILES

COC1=CC=CC=C1CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CC4=CNC5=C4C=C(C=C5)O

InChI

InChI=1S/C25H21N3O3S2/c1-31-22-5-3-2-4-15(22)14-32-25-28-21-8-6-17(11-23(21)33-25)27-24(30)10-16-13-26-20-9-7-18(29)12-19(16)20/h2-9,11-13,26,29H,10,14H2,1H3,(H,27,30)