1-[3-(2,4-dimethoxypyrimidin-5-yl)prop-2-enoylamino]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

Systemtic Name: 1-[3-(2,4-dimethoxypyrimidin-5-yl)prop-2-enoylamino]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 1-[3-(2,4-dimethoxypyrimidin-5-yl)prop-2-enoylamino]-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea CAS Name: 1-[[3-(2,4-dimethoxy-5-pyrimidinyl)-1-oxoprop-2-enyl]amino]-3-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]urea IUPAC Name: 1-[3-(2,4-dimethoxypyrimidin-5-yl)prop-2-enoylamino]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 1-[[3-(2,4-dimethoxypyrimidin-5-yl)acryloyl]amino]-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NNC(=O)C=CC2=CN=C(N=C2OC)OC

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NNC(=O)C=CC2=CN=C(N=C2OC)OC

InChI

InChI=1S/C22H27N5O4/c1-14(2)15-8-7-9-17(12-15)22(3,4)25-20(29)27-26-18(28)11-10-16-13-23-21(31-6)24-19(16)30-5/h7-13H,1H2,2-6H3,(H,26,28)(H2,25,27,29)