3-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-3H-2-benzofuran-1-one

Systemtic Name: 3-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-3H-2-benzofuran-1-one Openeye Name: 3-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-3H-isobenzofuran-1-one CAS Name: 3-[[5-(propylthio)-1,3,4-thiadiazol-2-yl]amino]-3H-isobenzofuran-1-one IUPAC Name: 3-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-3H-2-benzofuran-1-one Traditional Name: 3-[[5-(propylthio)-1,3,4-thiadiazol-2-yl]amino]phthalide Formula: C13H13N3O2S2 MolecularWeight: 307.39122

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCCSC1=NN=C(S1)NC2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C13H13N3O2S2/c1-2-7-19-13-16-15-12(20-13)14-10-8-5-3-4-6-9(8)11(17)18-10/h3-6,10H,2,7H2,1H3,(H,14,15)