3-(3-chloranyl-4-fluoranyl-phenyl)-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea IUPAC Name: 3-(3-chloro-4-fluorophenyl)-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-1-methyl-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Formula: C16H15ClFN3O2S MolecularWeight: 367.825603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H15ClFN3O2S/c1-10(11-4-3-5-13(8-11)21(22)23)20(2)16(24)19-12-6-7-15(18)14(17)9-12/h3-10H,1-2H3,(H,19,24)/t10-/m1/s1