ethyl N-[1-[[1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]carbonylamino]-4-methyl-pentan-2-yl]carbamate

Systemtic Name: ethyl N-[1-[[1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]carbonylamino]-4-methyl-pentan-2-yl]carbamate Openeye Name: ethyl N-[1-[[[1-(4-bromophenyl)-3,5-dimethyl-pyrazole-4-carbonyl]amino]methyl]-3-methyl-butyl]carbamate CAS Name: N-[1-[[[1-(4-bromophenyl)-3,5-dimethyl-4-pyrazolyl]-oxomethyl]amino]-4-methylpentan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[1-[[1-(4-bromophenyl)-3,5-dimethylpyrazole-4-carbonyl]amino]-4-methylpentan-2-yl]carbamate Traditional Name: N-[1-[[[1-(4-bromophenyl)-3,5-dimethyl-pyrazole-4-carbonyl]amino]methyl]-3-methyl-butyl]carbamic acid ethyl ester Formula: C21H29BrN4O3 MolecularWeight: 465.38396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC(C)C)CNC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)NC(CC(C)C)CNC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C21H29BrN4O3/c1-6-29-21(28)24-17(11-13(2)3)12-23-20(27)19-14(4)25-26(15(19)5)18-9-7-16(22)8-10-18/h7-10,13,17H,6,11-12H2,1-5H3,(H,23,27)(H,24,28)