ethyl 4-azanyl-2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(E)-3-(3,4-dichlorophenyl)-1-oxoprop-2-enoxy]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]oxymethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[(E)-3-(3,4-dichlorophenyl)acryloyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C20H17Cl2N3O5 MolecularWeight: 450.27208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C=CC3=CC(=C(C=C3)Cl)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)/C=C/C3=CC(=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C20H17Cl2N3O5/c1-3-28-20(27)16-10(2)30-19-17(16)18(23)24-14(25-19)9-29-15(26)7-5-11-4-6-12(21)13(22)8-11/h4-8H,3,9H2,1-2H3,(H2,23,24,25)/b7-5+