2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[2-(4-ethoxyphenoxy)ethylthio]-5-(4-methylphenyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[2-(4-ethoxyphenoxy)ethylthio]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C26H26N2O3S2 MolecularWeight: 478.62624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NC3=C(C(=CS3)C4=CC=C(C=C4)C)C(=O)N2CC=C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NC3=C(C(=CS3)C4=CC=C(C=C4)C)C(=O)N2CC=C

InChI

InChI=1S/C26H26N2O3S2/c1-4-14-28-25(29)23-22(19-8-6-18(3)7-9-19)17-33-24(23)27-26(28)32-16-15-31-21-12-10-20(11-13-21)30-5-2/h4,6-13,17H,1,5,14-16H2,2-3H3