1-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-oxoethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetyl]phenyl]-2-pyrrolidone Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)CSC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)CSC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H21NO4S/c23-18(15-4-6-16(7-5-15)22-10-1-3-21(22)24)14-27-17-8-9-19-20(13-17)26-12-2-11-25-19/h4-9,13H,1-3,10-12,14H2