N-[2-[(2-cyanophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]-1,3-benzothiazol-6-yl]acetamide Formula: C17H13N3OS2 MolecularWeight: 339.43462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3C#N

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3C#N

InChI

InChI=1S/C17H13N3OS2/c1-11(21)19-14-6-7-15-16(8-14)23-17(20-15)22-10-13-5-3-2-4-12(13)9-18/h2-8H,10H2,1H3,(H,19,21)