2-methylpropyl 4-[(8-ethyl-9H-carbazol-2-yl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methylpropyl 4-[(8-ethyl-9H-carbazol-2-yl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 4-[(8-ethyl-9H-carbazol-2-yl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[(8-ethyl-9H-carbazol-2-yl)amino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(8-ethyl-9H-carbazol-2-yl)amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[(8-ethyl-9H-carbazol-2-yl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC3=C2C=CC(=C3)NC4=C5C(=C(SC5=NC=N4)C(=O)OCC(C)C)C

Isomeric SMILES

CCC1=CC=CC2=C1NC3=C2C=CC(=C3)NC4=C5C(=C(SC5=NC=N4)C(=O)OCC(C)C)C

InChI

InChI=1S/C26H26N4O2S/c1-5-16-7-6-8-19-18-10-9-17(11-20(18)30-22(16)19)29-24-21-15(4)23(26(31)32-12-14(2)3)33-25(21)28-13-27-24/h6-11,13-14,30H,5,12H2,1-4H3,(H,27,28,29)