3-[(2-sulfanylphenyl)amino]-3H-2-benzofuran-1-one

Systemtic Name: 3-[(2-sulfanylphenyl)amino]-3H-2-benzofuran-1-one Openeye Name: 3-(2-sulfanylanilino)-3H-isobenzofuran-1-one CAS Name: 3-(2-mercaptoanilino)-3H-isobenzofuran-1-one IUPAC Name: 3-(2-sulfanylanilino)-3H-2-benzofuran-1-one Traditional Name: 3-(2-mercaptoanilino)phthalide Formula: C14H11NO2S MolecularWeight: 257.30764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)NC3=CC=CC=C3S

Isomeric SMILES

C1=CC=C2C(=C1)C(OC2=O)NC3=CC=CC=C3S

InChI

InChI=1S/C14H11NO2S/c16-14-10-6-2-1-5-9(10)13(17-14)15-11-7-3-4-8-12(11)18/h1-8,13,15,18H