(E)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(2-pyrrolidin-1-ylpyrimidin-5-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(2-pyrrolidin-1-ylpyrimidin-5-yl)prop-2-en-1-one Openeye Name: (E)-1-(5-chloro-2,4-dimethoxy-phenyl)-3-(2-pyrrolidin-1-ylpyrimidin-5-yl)prop-2-en-1-one CAS Name: (E)-1-(5-chloro-2,4-dimethoxyphenyl)-3-[2-(1-pyrrolidinyl)-5-pyrimidinyl]-2-propen-1-one IUPAC Name: (E)-1-(5-chloro-2,4-dimethoxyphenyl)-3-(2-pyrrolidin-1-ylpyrimidin-5-yl)prop-2-en-1-one Traditional Name: (E)-1-(5-chloro-2,4-dimethoxy-phenyl)-3-(2-pyrrolidinopyrimidin-5-yl)prop-2-en-1-one Formula: C19H20ClN3O3 MolecularWeight: 373.8334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)C=CC2=CN=C(N=C2)N3CCCC3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)/C=C/C2=CN=C(N=C2)N3CCCC3)Cl)OC

InChI

InChI=1S/C19H20ClN3O3/c1-25-17-10-18(26-2)15(20)9-14(17)16(24)6-5-13-11-21-19(22-12-13)23-7-3-4-8-23/h5-6,9-12H,3-4,7-8H2,1-2H3/b6-5+