(2-tert-butyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-tert-butyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (2-tert-butyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (2-tert-butyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (2-tert-butyl-4,5-dimethylthieno[2,3-d]pyrimidin-6-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (2-tert-butyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H26N6OS MolecularWeight: 410.53574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H26N6OS/c1-13-15-14(2)24-19(21(3,4)5)25-17(15)29-16(13)18(28)26-9-11-27(12-10-26)20-22-7-6-8-23-20/h6-8H,9-12H2,1-5H3