4-(1,3-benzoxazol-2-ylsulfanyl)-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-1-thiophen-2-yl-butan-1-one Openeye Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-1-(2-thienyl)butan-1-one CAS Name: 4-(1,3-benzoxazol-2-ylthio)-1-thiophen-2-yl-1-butanone IUPAC Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-1-thiophen-2-ylbutan-1-one Traditional Name: 4-(1,3-benzoxazol-2-ylthio)-1-(2-thienyl)butan-1-one Formula: C15H13NO2S2 MolecularWeight: 303.39922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCCCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C15H13NO2S2/c17-12(14-8-4-9-19-14)6-3-10-20-15-16-11-5-1-2-7-13(11)18-15/h1-2,4-5,7-9H,3,6,10H2