2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-(furan-2-yl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-(furan-2-yl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-5-(2-furyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl]thio]-5-(2-furanyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-5-(furan-2-yl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[[2-(2,6-dimethylpiperidino)-2-keto-ethyl]thio]-5-(2-furyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CC=C)C

Isomeric SMILES

CC1CCCC(N1C(=O)CSC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CC=C)C

InChI

InChI=1S/C22H25N3O3S2/c1-4-10-24-21(27)19-16(17-9-6-11-28-17)12-29-20(19)23-22(24)30-13-18(26)25-14(2)7-5-8-15(25)3/h4,6,9,11-12,14-15H,1,5,7-8,10,13H2,2-3H3