4-[4-(oxan-4-ylamino)-5-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-1-phenyl-piperazin-2-one

Systemtic Name: 4-[4-(oxan-4-ylamino)-5-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-1-phenyl-piperazin-2-one Openeye Name: 4-[5-oxo-4-(tetrahydropyran-4-ylamino)-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-1-phenyl-piperazin-2-one CAS Name: 4-[4-(4-oxanylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-1-phenyl-2-piperazinone IUPAC Name: 4-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-1-phenylpiperazin-2-one Traditional Name: 4-[5-keto-4-(tetrahydropyran-4-ylamino)-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-1-phenyl-piperazin-2-one Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC2=NC(=NC3=C2S(=O)CC3)N4CCN(C(=O)C4)C5=CC=CC=C5

Isomeric SMILES

C1COCCC1NC2=NC(=NC3=C2S(=O)CC3)N4CCN(C(=O)C4)C5=CC=CC=C5

InChI

InChI=1S/C21H25N5O3S/c27-18-14-25(9-10-26(18)16-4-2-1-3-5-16)21-23-17-8-13-30(28)19(17)20(24-21)22-15-6-11-29-12-7-15/h1-5,15H,6-14H2,(H,22,23,24)