5-phenyl-3-prop-2-enyl-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-phenyl-3-prop-2-enyl-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-5-phenyl-2-[3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-phenyl-3-prop-2-enyl-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-phenyl-3-prop-2-enyl-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-5-phenyl-2-[3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propylthio]thieno[2,3-d]pyrimidin-4-one Formula: C25H21N5O2S2 MolecularWeight: 487.59654

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCCCC3=NC(=NO3)C4=CC=NC=C4)SC=C2C5=CC=CC=C5

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCCCC3=NC(=NO3)C4=CC=NC=C4)SC=C2C5=CC=CC=C5

InChI

InChI=1S/C25H21N5O2S2/c1-2-14-30-24(31)21-19(17-7-4-3-5-8-17)16-34-23(21)28-25(30)33-15-6-9-20-27-22(29-32-20)18-10-12-26-13-11-18/h2-5,7-8,10-13,16H,1,6,9,14-15H2