1-(4-bromanyl-2-chloranyl-phenyl)-3-[2-(4-nitrophenyl)ethanoylamino]thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[2-(4-nitrophenyl)ethanoylamino]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[[2-(4-nitrophenyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea Formula: C15H12BrClN4O3S MolecularWeight: 443.70278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NNC(=S)NC2=C(C=C(C=C2)Br)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NNC(=S)NC2=C(C=C(C=C2)Br)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H12BrClN4O3S/c16-10-3-6-13(12(17)8-10)18-15(25)20-19-14(22)7-9-1-4-11(5-2-9)21(23)24/h1-6,8H,7H2,(H,19,22)(H2,18,20,25)