1-(4-chloranyl-3-nitro-phenyl)-3-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-(4-chloro-3-nitro-phenyl)-3-(2-furylmethyl)thiourea CAS Name: 1-(4-chloro-3-nitrophenyl)-3-(2-furanylmethyl)thiourea IUPAC Name: 1-(4-chloro-3-nitrophenyl)-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-(4-chloro-3-nitro-phenyl)-3-(2-furfuryl)thiourea Formula: C12H10ClN3O3S MolecularWeight: 311.7441

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CNC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H10ClN3O3S/c13-10-4-3-8(6-11(10)16(17)18)15-12(20)14-7-9-2-1-5-19-9/h1-6H,7H2,(H2,14,15,20)