2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-[(2-cyanophenyl)methylthio]ethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-[(2-cyanobenzyl)thio]ethyl]acetamide Formula: C20H19N3OS3 MolecularWeight: 413.57936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)CSCC2=NC3=CC=CC=C3S2)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)CSCC2=NC3=CC=CC=C3S2)C#N

InChI

InChI=1S/C20H19N3OS3/c21-11-15-5-1-2-6-16(15)12-25-10-9-22-19(24)13-26-14-20-23-17-7-3-4-8-18(17)27-20/h1-8H,9-10,12-14H2,(H,22,24)