ethyl (E)-3-[1-(2-azanyl-6-chloranyl-pyrimidin-4-yl)-5-propan-2-yl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[1-(2-azanyl-6-chloranyl-pyrimidin-4-yl)-5-propan-2-yl-pyrazol-4-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[1-(2-amino-6-chloro-pyrimidin-4-yl)-5-isopropyl-pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[1-(2-amino-6-chloro-4-pyrimidinyl)-5-propan-2-yl-4-pyrazolyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[1-(2-amino-6-chloropyrimidin-4-yl)-5-propan-2-ylpyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[1-(2-amino-6-chloro-pyrimidin-4-yl)-5-isopropyl-pyrazol-4-yl]acrylic acid ethyl ester Formula: C15H18ClN5O2 MolecularWeight: 335.78872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(N(N=C1)C2=CC(=NC(=N2)N)Cl)C(C)C

Isomeric SMILES

CCOC(=O)/C=C/C1=C(N(N=C1)C2=CC(=NC(=N2)N)Cl)C(C)C

InChI

InChI=1S/C15H18ClN5O2/c1-4-23-13(22)6-5-10-8-18-21(14(10)9(2)3)12-7-11(16)19-15(17)20-12/h5-9H,4H2,1-3H3,(H2,17,19,20)/b6-5+