N,N-diethyl-5-methyl-4-oxidanylidene-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N,N-diethyl-5-methyl-4-oxidanylidene-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N,N-diethyl-5-methyl-4-oxo-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N,N-diethyl-5-methyl-4-oxo-3-[2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N,N-diethyl-5-methyl-4-oxo-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N,N-diethyl-4-keto-5-methyl-3-[2-[4-(2-pyrimidyl)piperazino]ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H29N7O2S MolecularWeight: 455.57636

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C2=C(S1)N=CN(C2=O)CCN3CCN(CC3)C4=NC=CC=N4)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C2=C(S1)N=CN(C2=O)CCN3CCN(CC3)C4=NC=CC=N4)C

InChI

InChI=1S/C22H29N7O2S/c1-4-27(5-2)21(31)18-16(3)17-19(32-18)25-15-29(20(17)30)14-11-26-9-12-28(13-10-26)22-23-7-6-8-24-22/h6-8,15H,4-5,9-14H2,1-3H3