1-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-[[2-(2-chloro-6-fluorophenyl)-1-oxoethyl]amino]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C16H14ClFN4O4S MolecularWeight: 412.823163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC(=O)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC(=O)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C16H14ClFN4O4S/c1-26-14-7-9(22(24)25)5-6-13(14)19-16(27)21-20-15(23)8-10-11(17)3-2-4-12(10)18/h2-7H,8H2,1H3,(H,20,23)(H2,19,21,27)