1-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(4-nitrophenyl)urea Openeye Name: 1-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(4-nitrophenyl)urea CAS Name: 1-[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(4-nitrophenyl)urea Traditional Name: 1-[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]-3-(4-nitrophenyl)urea Formula: C17H12BrCl2N5O3 MolecularWeight: 485.11888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H12BrCl2N5O3/c18-13-9-24(8-10-1-6-14(19)15(20)7-10)23-16(13)22-17(26)21-11-2-4-12(5-3-11)25(27)28/h1-7,9H,8H2,(H2,21,22,23,26)