dimethyl 3-[4-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]pyrazol-1-yl]pentanedioate CAS Name: 3-[4-[[[2-[3-(1-methylethenyl)phenyl]propan-2-ylamino]-oxomethyl]amino]-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]pyrazol-1-yl]glutaric acid dimethyl ester Formula: C23H30N4O5 MolecularWeight: 442.5081

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NC2=CN(N=C2)C(CC(=O)OC)CC(=O)OC

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NC2=CN(N=C2)C(CC(=O)OC)CC(=O)OC

InChI

InChI=1S/C23H30N4O5/c1-15(2)16-8-7-9-17(10-16)23(3,4)26-22(30)25-18-13-24-27(14-18)19(11-20(28)31-5)12-21(29)32-6/h7-10,13-14,19H,1,11-12H2,2-6H3,(H2,25,26,30)