2-benzo[e][1]benzofuran-1-yl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-benzo[e][1]benzofuran-1-yl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-benzo[e]benzofuran-1-yl-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-(1-benzo[e]benzofuranyl)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-benzo[e][1]benzofuran-1-yl-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-benzo[e]benzofuran-1-yl-N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]acetamide Formula: C23H17N3O2S2 MolecularWeight: 431.52998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C23H17N3O2S2/c27-20(24-22-25-26-23(30-22)29-14-15-6-2-1-3-7-15)12-17-13-28-19-11-10-16-8-4-5-9-18(16)21(17)19/h1-11,13H,12,14H2,(H,24,25,27)