3-[4-(4-methylphenoxy)butyl]-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[4-(4-methylphenoxy)butyl]-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-isopropylphenyl)-3-[4-(4-methylphenoxy)butyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[4-(4-methylphenoxy)butyl]-5-(4-propan-2-ylphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[4-(4-methylphenoxy)butyl]-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[4-(4-methylphenoxy)butyl]-5-p-cumenyl-thieno[2,3-d]pyrimidin-4-one Formula: C26H28N2O2S MolecularWeight: 432.57772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCCN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCCCCN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C26H28N2O2S/c1-18(2)20-8-10-21(11-9-20)23-16-31-25-24(23)26(29)28(17-27-25)14-4-5-15-30-22-12-6-19(3)7-13-22/h6-13,16-18H,4-5,14-15H2,1-3H3