(5E)-2-[4-(4-nitrophenyl)piperazin-1-yl]-5-(phenylmethylidene)-1,3-thiazol-4-one

Systemtic Name: (5E)-2-[4-(4-nitrophenyl)piperazin-1-yl]-5-(phenylmethylidene)-1,3-thiazol-4-one Openeye Name: (5E)-5-benzylidene-2-[4-(4-nitrophenyl)piperazin-1-yl]thiazol-4-one CAS Name: (5E)-2-[4-(4-nitrophenyl)-1-piperazinyl]-5-(phenylmethylene)-4-thiazolone IUPAC Name: (5E)-5-benzylidene-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4-one Traditional Name: (5E)-5-benzal-2-[4-(4-nitrophenyl)piperazino]-2-thiazolin-4-one Formula: C20H18N4O3S MolecularWeight: 394.44692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=O)C(=CC4=CC=CC=C4)S3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=O)/C(=C\C4=CC=CC=C4)/S3

InChI

InChI=1S/C20H18N4O3S/c25-19-18(14-15-4-2-1-3-5-15)28-20(21-19)23-12-10-22(11-13-23)16-6-8-17(9-7-16)24(26)27/h1-9,14H,10-13H2/b18-14+