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

Systemtic Name: N,N,5-trimethyl-4-oxidanylidene-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N,N,5-trimethyl-4-oxo-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N,N,5-trimethyl-4-oxo-3-[2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N,N,5-trimethyl-4-oxo-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-keto-N,N,5-trimethyl-3-[2-[4-(2-pyrimidyl)piperazino]ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H25N7O2S MolecularWeight: 427.5232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCN3CCN(CC3)C4=NC=CC=N4)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCN3CCN(CC3)C4=NC=CC=N4)C(=O)N(C)C

InChI

InChI=1S/C20H25N7O2S/c1-14-15-17(30-16(14)19(29)24(2)3)23-13-27(18(15)28)12-9-25-7-10-26(11-8-25)20-21-5-4-6-22-20/h4-6,13H,7-12H2,1-3H3