ethyl 4-[4-(4-hydroxyphenyl)piperidin-1-yl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[4-(4-hydroxyphenyl)piperidin-1-yl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[4-(4-hydroxyphenyl)-1-piperidyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[4-(4-hydroxyphenyl)-1-piperidinyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-hydroxyphenyl)piperidin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[4-(4-hydroxyphenyl)piperidino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)N3CCC(CC3)C4=CC=C(C=C4)O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)N3CCC(CC3)C4=CC=C(C=C4)O)C

InChI

InChI=1S/C21H23N3O3S/c1-3-27-21(26)18-13(2)17-19(22-12-23-20(17)28-18)24-10-8-15(9-11-24)14-4-6-16(25)7-5-14/h4-7,12,15,25H,3,8-11H2,1-2H3