2-[(4-methoxyphenyl)-phenylsulfanyl-methyl]isoindole-1,3-dione

Systemtic Name: 2-[(4-methoxyphenyl)-phenylsulfanyl-methyl]isoindole-1,3-dione Openeye Name: 2-[(4-methoxyphenyl)-phenylsulfanyl-methyl]isoindoline-1,3-dione CAS Name: 2-[(4-methoxyphenyl)-(phenylthio)methyl]isoindole-1,3-dione IUPAC Name: 2-[(4-methoxyphenyl)-phenylsulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[(4-methoxyphenyl)-(phenylthio)methyl]isoindoline-1,3-quinone Formula: C22H17NO3S MolecularWeight: 375.44028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(N2C(=O)C3=CC=CC=C3C2=O)SC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(N2C(=O)C3=CC=CC=C3C2=O)SC4=CC=CC=C4

InChI

InChI=1S/C22H17NO3S/c1-26-16-13-11-15(12-14-16)22(27-17-7-3-2-4-8-17)23-20(24)18-9-5-6-10-19(18)21(23)25/h2-14,22H,1H3