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

Systemtic Name: N,N,5-trimethyl-4-oxidanylidene-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N,N,5-trimethyl-4-oxo-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N,N,5-trimethyl-4-oxo-3-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N,N,5-trimethyl-4-oxo-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-keto-N,N,5-trimethyl-3-[3-[4-(2-pyrimidyl)piperazino]propyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H27N7O2S MolecularWeight: 441.54978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCCN3CCN(CC3)C4=NC=CC=N4)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCCN3CCN(CC3)C4=NC=CC=N4)C(=O)N(C)C

InChI

InChI=1S/C21H27N7O2S/c1-15-16-18(31-17(15)20(30)25(2)3)24-14-28(19(16)29)9-5-8-26-10-12-27(13-11-26)21-22-6-4-7-23-21/h4,6-7,14H,5,8-13H2,1-3H3