3-(3-methylbutyl)-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3-methylbutyl)-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-isopentyl-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3-methylbutyl)-5-(4-propoxyphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3-methylbutyl)-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-isoamyl-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one Formula: C20H24N2O2S MolecularWeight: 356.48176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCC(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCC(C)C

InChI

InChI=1S/C20H24N2O2S/c1-4-11-24-16-7-5-15(6-8-16)17-12-25-19-18(17)20(23)22(13-21-19)10-9-14(2)3/h5-8,12-14H,4,9-11H2,1-3H3