ethyl 4-azanyl-6-methyl-2-[5-methyl-4-(4-methylpiperazin-1-yl)-2-phenyl-thieno[2,3-d]pyrimidin-6-yl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-6-methyl-2-[5-methyl-4-(4-methylpiperazin-1-yl)-2-phenyl-thieno[2,3-d]pyrimidin-6-yl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-[5-methyl-4-(4-methylpiperazin-1-yl)-2-phenyl-thieno[2,3-d]pyrimidin-6-yl]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[5-methyl-4-(4-methyl-1-piperazinyl)-2-phenyl-6-thieno[2,3-d]pyrimidinyl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-[5-methyl-4-(4-methylpiperazin-1-yl)-2-phenylthieno[2,3-d]pyrimidin-6-yl]pyrimidine-5-carboxylate Traditional Name: 4-amino-6-methyl-2-[5-methyl-4-(4-methylpiperazino)-2-phenyl-thieno[2,3-d]pyrimidin-6-yl]pyrimidine-5-carboxylic acid ethyl ester Formula: C26H29N7O2S MolecularWeight: 503.61916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1N)C2=C(C3=C(N=C(N=C3S2)C4=CC=CC=C4)N5CCN(CC5)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1N)C2=C(C3=C(N=C(N=C3S2)C4=CC=CC=C4)N5CCN(CC5)C)C)C

InChI

InChI=1S/C26H29N7O2S/c1-5-35-26(34)19-16(3)28-23(29-21(19)27)20-15(2)18-24(33-13-11-32(4)12-14-33)30-22(31-25(18)36-20)17-9-7-6-8-10-17/h6-10H,5,11-14H2,1-4H3,(H2,27,28,29)