(4E)-2-naphthalen-1-yl-4-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4E)-2-naphthalen-1-yl-4-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methylidene]-1,3-oxazol-5-one Openeye Name: (4E)-2-(1-naphthyl)-4-[[4-(8-quinolylsulfonyl)-1,4-diazepan-1-yl]methylene]oxazol-5-one CAS Name: (4E)-2-(1-naphthalenyl)-4-[[4-(8-quinolinylsulfonyl)-1,4-diazepan-1-yl]methylidene]-5-oxazolone IUPAC Name: (4E)-2-naphthalen-1-yl-4-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methylidene]-1,3-oxazol-5-one Traditional Name: (4E)-2-(1-naphthyl)-4-[[4-(8-quinolylsulfonyl)-1,4-diazepan-1-yl]methylene]-2-oxazolin-5-one Formula: C28H24N4O4S MolecularWeight: 512.57956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C=C4C(=O)OC(=N4)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)/C=C/4\C(=O)OC(=N4)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C28H24N4O4S/c33-28-24(30-27(36-28)23-12-3-8-20-7-1-2-11-22(20)23)19-31-15-6-16-32(18-17-31)37(34,35)25-13-4-9-21-10-5-14-29-26(21)25/h1-5,7-14,19H,6,15-18H2/b24-19+