1-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethanoylamino]-3-(3,4-dimethylphenyl)urea

Systemtic Name: 1-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethanoylamino]-3-(3,4-dimethylphenyl)urea Openeye Name: 1-[[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-(3,4-dimethylphenyl)urea CAS Name: 1-[[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]-3-(3,4-dimethylphenyl)urea IUPAC Name: 1-[[2-(4-bromo-3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-(3,4-dimethylphenyl)urea Traditional Name: 1-[[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-(3,4-dimethylphenyl)urea Formula: C16H20BrN5O2 MolecularWeight: 394.2663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NNC(=O)CN2C(=C(C(=N2)C)Br)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NNC(=O)CN2C(=C(C(=N2)C)Br)C)C

InChI

InChI=1S/C16H20BrN5O2/c1-9-5-6-13(7-10(9)2)18-16(24)20-19-14(23)8-22-12(4)15(17)11(3)21-22/h5-7H,8H2,1-4H3,(H,19,23)(H2,18,20,24)