ethyl 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-[4-(2,5-dimethylphenyl)-1-piperazinyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-[4-(2,5-dimethylphenyl)piperazino]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC=NC(=C12)N3CCN(CC3)C4=C(C=CC(=C4)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC=NC(=C12)N3CCN(CC3)C4=C(C=CC(=C4)C)C)C

InChI

InChI=1S/C22H26N4O3/c1-5-28-22(27)18-16(4)29-21-19(18)20(23-13-24-21)26-10-8-25(9-11-26)17-12-14(2)6-7-15(17)3/h6-7,12-13H,5,8-11H2,1-4H3