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

Systemtic Name: 5-cyclopropyl-2-[2-(2-ethanoylphenoxy)ethylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(2-acetylphenoxy)ethylsulfanyl]-3-allyl-5-cyclopropyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[2-(2-acetylphenoxy)ethylthio]-5-cyclopropyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(2-acetylphenoxy)ethylsulfanyl]-5-cyclopropyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[2-(2-acetylphenoxy)ethylthio]-3-allyl-5-cyclopropyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OCCSC2=NC3=C(C(=CS3)C4CC4)C(=O)N2CC=C

Isomeric SMILES

CC(=O)C1=CC=CC=C1OCCSC2=NC3=C(C(=CS3)C4CC4)C(=O)N2CC=C

InChI

InChI=1S/C22H22N2O3S2/c1-3-10-24-21(26)19-17(15-8-9-15)13-29-20(19)23-22(24)28-12-11-27-18-7-5-4-6-16(18)14(2)25/h3-7,13,15H,1,8-12H2,2H3