2-methylpropyl 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methylpropyl 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[2-(1H-indol-3-yl)ethylamino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC3=CNC4=CC=CC=C43)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC3=CNC4=CC=CC=C43)C(=O)OCC(C)C

InChI

InChI=1S/C22H24N4O2S/c1-13(2)11-28-22(27)19-14(3)18-20(25-12-26-21(18)29-19)23-9-8-15-10-24-17-7-5-4-6-16(15)17/h4-7,10,12-13,24H,8-9,11H2,1-3H3,(H,23,25,26)