[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-(3-phenyl-2-thioxo-1H-imidazol-4-yl)methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-(3-phenyl-2-thioxo-4-imidazolin-4-yl)methanone Formula: C20H18ClN5O3S MolecularWeight: 443.90662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=CNC(=S)N3C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=CNC(=S)N3C4=CC=CC=C4

InChI

InChI=1S/C20H18ClN5O3S/c21-14-6-7-16(17(12-14)26(28)29)23-8-10-24(11-9-23)19(27)18-13-22-20(30)25(18)15-4-2-1-3-5-15/h1-7,12-13H,8-11H2,(H,22,30)