6-ethyl-3-[(2S)-3-(2-methoxy-4-prop-2-enyl-phenoxy)-2-oxidanyl-propyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-3-[(2S)-3-(2-methoxy-4-prop-2-enyl-phenoxy)-2-oxidanyl-propyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(2S)-3-(4-allyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-3-[(2S)-2-hydroxy-3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-ethyl-3-[(2S)-2-hydroxy-3-(2-methoxy-4-prop-2-enylphenoxy)propyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(2S)-3-(4-allyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CC(COC3=C(C=C(C=C3)CC=C)OC)O

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)C[C@@H](COC3=C(C=C(C=C3)CC=C)OC)O

InChI

InChI=1S/C21H24N2O4S/c1-4-6-14-7-8-18(19(9-14)26-3)27-12-15(24)11-23-13-22-20-17(21(23)25)10-16(5-2)28-20/h4,7-10,13,15,24H,1,5-6,11-12H2,2-3H3/t15-/m0/s1