(4E)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)methylidene]-2-naphthalen-1-yl-1,3-oxazol-5-one

Systemtic Name: (4E)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)methylidene]-2-naphthalen-1-yl-1,3-oxazol-5-one Openeye Name: (4E)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)methylene]-2-(1-naphthyl)oxazol-5-one CAS Name: (4E)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)methylidene]-2-(1-naphthalenyl)-5-oxazolone IUPAC Name: (4E)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)methylidene]-2-naphthalen-1-yl-1,3-oxazol-5-one Traditional Name: (4E)-4-[(4-mesyl-1,4-diazepan-1-yl)methylene]-2-(1-naphthyl)-2-oxazolin-5-one Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C=C2C(=O)OC(=N2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)/C=C/2\C(=O)OC(=N2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C20H21N3O4S/c1-28(25,26)23-11-5-10-22(12-13-23)14-18-20(24)27-19(21-18)17-9-4-7-15-6-2-3-8-16(15)17/h2-4,6-9,14H,5,10-13H2,1H3/b18-14+