2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-(1H-indol-3-yl)-2-phenylethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(1H-indol-3-yl)-2-phenylethyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]acetamide Formula: C26H23N3OS2 MolecularWeight: 457.61032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)CSCC2=NC3=CC=CC=C3S2)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)CSCC2=NC3=CC=CC=C3S2)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H23N3OS2/c30-25(16-31-17-26-29-23-12-6-7-13-24(23)32-26)28-14-20(18-8-2-1-3-9-18)21-15-27-22-11-5-4-10-19(21)22/h1-13,15,20,27H,14,16-17H2,(H,28,30)