2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-5-phenyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(2-keto-2-piperidino-ethyl)thio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC(=O)N3CCCCC3)SC=C2C4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC(=O)N3CCCCC3)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2S2/c1-2-11-25-21(27)19-17(16-9-5-3-6-10-16)14-28-20(19)23-22(25)29-15-18(26)24-12-7-4-8-13-24/h2-3,5-6,9-10,14H,1,4,7-8,11-13,15H2