1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one

Systemtic Name: 1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one Openeye Name: 1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one CAS Name: 1-[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one IUPAC Name: 1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one Traditional Name: 1-[4-(2-ketopyrrolidino)phenyl]sulfonyl-7-phenyl-1,4-diazepan-5-one Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)CC3C4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)CC3C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O4S/c25-20-15-19(16-5-2-1-3-6-16)24(14-12-22-20)29(27,28)18-10-8-17(9-11-18)23-13-4-7-21(23)26/h1-3,5-6,8-11,19H,4,7,12-15H2,(H,22,25)