1-(4-bromanyl-2-chloranyl-phenyl)-3-(4-methyl-2-nitro-phenyl)thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-(4-methyl-2-nitro-phenyl)thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-(4-methyl-2-nitro-phenyl)thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-(4-methyl-2-nitrophenyl)thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-(4-methyl-2-nitrophenyl)thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-(4-methyl-2-nitro-phenyl)thiourea Formula: C14H11BrClN3O2S MolecularWeight: 400.67804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC2=C(C=C(C=C2)Br)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC2=C(C=C(C=C2)Br)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H11BrClN3O2S/c1-8-2-4-12(13(6-8)19(20)21)18-14(22)17-11-5-3-9(15)7-10(11)16/h2-7H,1H3,(H2,17,18,22)