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

Systemtic Name: 2-[1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl]sulfanyl-3-prop-2-enyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-(4-benzyl-1-piperidyl)-1-methyl-2-oxo-ethyl]sulfanyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[1-oxo-1-[4-(phenylmethyl)-1-piperidinyl]propan-2-yl]thio]-3-prop-2-enyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-3-prop-2-enylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[[2-(4-benzylpiperidino)-2-keto-1-methyl-ethyl]thio]thieno[3,2-d]pyrimidin-4-one Formula: C24H27N3O2S2 MolecularWeight: 453.62008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)SC3=NC4=C(C(=O)N3CC=C)SC=C4

Isomeric SMILES

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)SC3=NC4=C(C(=O)N3CC=C)SC=C4

InChI

InChI=1S/C24H27N3O2S2/c1-3-12-27-23(29)21-20(11-15-30-21)25-24(27)31-17(2)22(28)26-13-9-19(10-14-26)16-18-7-5-4-6-8-18/h3-8,11,15,17,19H,1,9-10,12-14,16H2,2H3