(4-methylpiperazin-1-yl)-[5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]methanone

Systemtic Name: (4-methylpiperazin-1-yl)-[5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: (4-methylpiperazin-1-yl)-[5-methyl-4-[4-(2-pyridyl)piperazin-1-yl]thieno[2,3-d]pyrimidin-6-yl]methanone CAS Name: (4-methyl-1-piperazinyl)-[5-methyl-4-[4-(2-pyridinyl)-1-piperazinyl]-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]methanone Traditional Name: (4-methylpiperazino)-[5-methyl-4-[4-(2-pyridyl)piperazino]thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C22H27N7OS MolecularWeight: 437.56108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=N4)C(=O)N5CCN(CC5)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=N4)C(=O)N5CCN(CC5)C

InChI

InChI=1S/C22H27N7OS/c1-16-18-20(28-13-11-27(12-14-28)17-5-3-4-6-23-17)24-15-25-21(18)31-19(16)22(30)29-9-7-26(2)8-10-29/h3-6,15H,7-14H2,1-2H3