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

Systemtic Name: cyclohexyl 4-[(8-ethyl-9H-carbazol-2-yl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 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 cyclohexyl ester IUPAC Name: cyclohexyl 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 cyclohexyl ester Formula: C28H28N4O2S MolecularWeight: 484.61252

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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)OC6CCCCC6)C

Isomeric SMILES

CCC1=CC=CC2=C1NC3=C2C=CC(=C3)NC4=C5C(=C(SC5=NC=N4)C(=O)OC6CCCCC6)C

InChI

InChI=1S/C28H28N4O2S/c1-3-17-8-7-11-21-20-13-12-18(14-22(20)32-24(17)21)31-26-23-16(2)25(35-27(23)30-15-29-26)28(33)34-19-9-5-4-6-10-19/h7-8,11-15,19,32H,3-6,9-10H2,1-2H3,(H,29,30,31)