1-(2-chloranyl-5-nitro-phenyl)-3-[[2-(furan-2-yl)quinolin-4-yl]carbonylamino]thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[[2-(furan-2-yl)quinolin-4-yl]carbonylamino]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[[2-(2-furyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[[[2-(2-furanyl)-4-quinolinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[[2-(furan-2-yl)quinoline-4-carbonyl]amino]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[[2-(2-furyl)quinoline-4-carbonyl]amino]thiourea Formula: C21H14ClN5O4S MolecularWeight: 467.88496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CO3)C(=O)NNC(=S)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CO3)C(=O)NNC(=S)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H14ClN5O4S/c22-15-8-7-12(27(29)30)10-17(15)24-21(32)26-25-20(28)14-11-18(19-6-3-9-31-19)23-16-5-2-1-4-13(14)16/h1-11H,(H,25,28)(H2,24,26,32)