methyl 2-[[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoylamino]benzoate

Systemtic Name: methyl 2-[[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoylamino]benzoate Openeye Name: methyl 2-[[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoylamino]benzoate CAS Name: 2-[[[[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]amino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoylamino]benzoate Traditional Name: 2-[[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]carbamoylamino]benzoic acid methyl ester Formula: C19H15BrCl2N4O3 MolecularWeight: 498.1574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H15BrCl2N4O3/c1-29-18(27)12-4-2-3-5-16(12)23-19(28)24-17-13(20)10-26(25-17)9-11-6-7-14(21)15(22)8-11/h2-8,10H,9H2,1H3,(H2,23,24,25,28)