5-methyl-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-6-(4-phenylpiperazin-1-yl)carbonyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-methyl-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-6-(4-phenylpiperazin-1-yl)carbonyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-methyl-3-[2-oxo-2-(1-piperidyl)ethyl]-6-(4-phenylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-6-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-[2-oxo-2-(1-piperidinyl)ethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-methyl-3-(2-oxo-2-piperidin-1-ylethyl)-6-(4-phenylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-keto-2-piperidino-ethyl)-5-methyl-6-(4-phenylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCCC3)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCCC3)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H29N5O3S/c1-18-21-23(26-17-30(24(21)32)16-20(31)28-10-6-3-7-11-28)34-22(18)25(33)29-14-12-27(13-15-29)19-8-4-2-5-9-19/h2,4-5,8-9,17H,3,6-7,10-16H2,1H3