6-methyl-3-(4-oxidanylbutyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-3-(4-oxidanylbutyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(4-hydroxybutyl)-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(4-hydroxybutyl)-6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(4-hydroxybutyl)-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-hydroxybutyl)-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CCCCO)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CCCCO)C3=CC=CC=C3

InChI

InChI=1S/C17H18N2O2S/c1-12-14(13-7-3-2-4-8-13)15-16(22-12)18-11-19(17(15)21)9-5-6-10-20/h2-4,7-8,11,20H,5-6,9-10H2,1H3