3-[2-oxidanylidene-2-(4-pyridin-4-ylcarbonylpiperazin-1-yl)ethyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-(4-pyridin-4-ylcarbonylpiperazin-1-yl)ethyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-oxo-2-[4-(pyridine-4-carbonyl)piperazin-1-yl]ethyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-oxo-2-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]ethyl]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-oxo-2-[4-(pyridine-4-carbonyl)piperazin-1-yl]ethyl]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(4-isonicotinoylpiperazino)-2-keto-ethyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H21N5O3S MolecularWeight: 459.52024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)C(=O)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)C(=O)C5=CC=NC=C5

InChI

InChI=1S/C24H21N5O3S/c30-21(27-10-12-28(13-11-27)23(31)18-6-8-25-9-7-18)15-29-16-26-22-19(24(29)32)14-20(33-22)17-4-2-1-3-5-17/h1-9,14,16H,10-13,15H2