3-[3-(2-methoxy-4-prop-2-enyl-phenoxy)-2-oxidanyl-propyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[3-(2-methoxy-4-prop-2-enyl-phenoxy)-2-oxidanyl-propyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[3-(4-allyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-hydroxy-3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-hydroxy-3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[3-(4-allyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(COC4=C(C=C(C=C4)CC=C)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(COC4=C(C=C(C=C4)CC=C)OC)O

InChI

InChI=1S/C26H26N2O4S/c1-4-5-18-8-11-22(23(12-18)31-3)32-14-20(29)13-28-16-27-25-24(26(28)30)21(15-33-25)19-9-6-17(2)7-10-19/h4,6-12,15-16,20,29H,1,5,13-14H2,2-3H3