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

Systemtic Name: 5-methyl-3-(2-oxidanylidenepropyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-acetonyl-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-3-(2-oxopropyl)-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-methyl-3-(2-oxopropyl)-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-acetonyl-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O2S/c1-10(19)8-18-9-17-15-13(16(18)20)11(2)14(21-15)12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3