(5-methyl-2-propan-2-yl-cyclohexyl) N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)phenyl]carbamate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)phenyl]carbamate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) N-[3-(4-bromo-2-methyl-pyrazol-3-yl)phenyl]carbamate CAS Name: N-[3-(4-bromo-2-methyl-3-pyrazolyl)phenyl]carbamic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) N-[3-(4-bromo-2-methylpyrazol-3-yl)phenyl]carbamate Traditional Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)phenyl]carbamic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C21H28BrN3O2 MolecularWeight: 434.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)NC2=CC=CC(=C2)C3=C(C=NN3C)Br)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)NC2=CC=CC(=C2)C3=C(C=NN3C)Br)C(C)C

InChI

InChI=1S/C21H28BrN3O2/c1-13(2)17-9-8-14(3)10-19(17)27-21(26)24-16-7-5-6-15(11-16)20-18(22)12-23-25(20)4/h5-7,11-14,17,19H,8-10H2,1-4H3,(H,24,26)