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

Systemtic Name: 3-[[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]-3H-2-benzofuran-1-one Openeye Name: 3-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-3H-isobenzofuran-1-one CAS Name: 3-[[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]amino]-3H-isobenzofuran-1-one IUPAC Name: 3-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-3H-2-benzofuran-1-one Traditional Name: 3-[[5-(benzylthio)-1,3,4-thiadiazol-2-yl]amino]phthalide Formula: C17H13N3O2S2 MolecularWeight: 355.43402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C17H13N3O2S2/c21-15-13-9-5-4-8-12(13)14(22-15)18-16-19-20-17(24-16)23-10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,18,19)