3-[[(3R)-3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)butanoyl]amino]-1-methyl-1-(4-methylphenyl)urea

Systemtic Name: 3-[[(3R)-3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)butanoyl]amino]-1-methyl-1-(4-methylphenyl)urea Openeye Name: 3-[[(3R)-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)butanoyl]amino]-1-methyl-1-(p-tolyl)urea CAS Name: 3-[[(3R)-3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-oxobutyl]amino]-1-methyl-1-(4-methylphenyl)urea IUPAC Name: 3-[[(3R)-3-(4-bromo-3,5-dimethylpyrazol-1-yl)butanoyl]amino]-1-methyl-1-(4-methylphenyl)urea Traditional Name: 3-[[(3R)-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)butanoyl]amino]-1-methyl-1-(p-tolyl)urea Formula: C18H24BrN5O2 MolecularWeight: 422.31946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C)C(=O)NNC(=O)CC(C)N2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C)C(=O)NNC(=O)C[C@@H](C)N2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C18H24BrN5O2/c1-11-6-8-15(9-7-11)23(5)18(26)21-20-16(25)10-12(2)24-14(4)17(19)13(3)22-24/h6-9,12H,10H2,1-5H3,(H,20,25)(H,21,26)/t12-/m1/s1