2-methylpropyl 4-[4-(2-hydroxyethyl)piperazin-1-yl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methylpropyl 4-[4-(2-hydroxyethyl)piperazin-1-yl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 4-[4-(2-hydroxyethyl)piperazin-1-yl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[4-(2-hydroxyethyl)-1-piperazinyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[4-(2-hydroxyethyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[4-(2-hydroxyethyl)piperazino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C18H26N4O3S MolecularWeight: 378.48904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)CCO)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)CCO)C(=O)OCC(C)C

InChI

InChI=1S/C18H26N4O3S/c1-12(2)10-25-18(24)15-13(3)14-16(19-11-20-17(14)26-15)22-6-4-21(5-7-22)8-9-23/h11-12,23H,4-10H2,1-3H3