5,6-bis(phenylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 5,6-bis(phenylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 5,6-bis(phenylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 5,6-bis(phenylthio)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 5,6-bis(phenylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 5,6-bis(phenylthio)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C20H17NO2S2 MolecularWeight: 367.48448

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(CC(=C1SC3=CC=CC=C3)SC4=CC=CC=C4)C(=O)NC2=O

Isomeric SMILES

C1C2C(CC(=C1SC3=CC=CC=C3)SC4=CC=CC=C4)C(=O)NC2=O

InChI

InChI=1S/C20H17NO2S2/c22-19-15-11-17(24-13-7-3-1-4-8-13)18(12-16(15)20(23)21-19)25-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,21,22,23)