1-(1-benzofuran-2-ylsulfanyl)-3-(benzotriazol-1-yl)propan-2-one

Systemtic Name: 1-(1-benzofuran-2-ylsulfanyl)-3-(benzotriazol-1-yl)propan-2-one Openeye Name: 1-(benzofuran-2-ylsulfanyl)-3-(benzotriazol-1-yl)propan-2-one CAS Name: 1-(2-benzofuranylthio)-3-(1-benzotriazolyl)-2-propanone IUPAC Name: 1-(1-benzofuran-2-ylsulfanyl)-3-(benzotriazol-1-yl)propan-2-one Traditional Name: 1-(benzofuran-2-ylthio)-3-(benzotriazol-1-yl)acetone Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)SCC(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)SCC(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H13N3O2S/c21-13(10-20-15-7-3-2-6-14(15)18-19-20)11-23-17-9-12-5-1-4-8-16(12)22-17/h1-9H,10-11H2