4-(4,5-dithiophen-2-yl-1,3-dihydroimidazol-2-ylidene)-2-nitro-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(4,5-dithiophen-2-yl-1,3-dihydroimidazol-2-ylidene)-2-nitro-cyclohexa-2,5-dien-1-one Openeye Name: 4-[4,5-bis(2-thienyl)-1,3-dihydroimidazol-2-ylidene]-2-nitro-cyclohexa-2,5-dien-1-one CAS Name: 4-(4,5-dithiophen-2-yl-1,3-dihydroimidazol-2-ylidene)-2-nitro-1-cyclohexa-2,5-dienone IUPAC Name: 4-(4,5-dithiophen-2-yl-1,3-dihydroimidazol-2-ylidene)-2-nitrocyclohexa-2,5-dien-1-one Traditional Name: 4-[4,5-bis(2-thienyl)-4-imidazolin-2-ylidene]-2-nitro-cyclohexa-2,5-dien-1-one Formula: C17H11N3O3S2 MolecularWeight: 369.41754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C(NC(=C3C=CC(=O)C(=C3)[N+](=O)[O-])N2)C4=CC=CS4

Isomeric SMILES

C1=CSC(=C1)C2=C(NC(=C3C=CC(=O)C(=C3)[N+](=O)[O-])N2)C4=CC=CS4

InChI

InChI=1S/C17H11N3O3S2/c21-12-6-5-10(9-11(12)20(22)23)17-18-15(13-3-1-7-24-13)16(19-17)14-4-2-8-25-14/h1-9,18-19H