3-[2-[4-(2-methylpropanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-[4-(2-methylpropanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-[4-(2-methylpropanoyl)piperazin-1-yl]-2-oxo-ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-[4-(2-methylpropanoyl)piperazin-1-yl]-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(4-isobutyrylpiperazino)-2-keto-ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C16H20N4O3S/c1-11(2)15(22)19-6-4-18(5-7-19)13(21)9-20-10-17-14-12(16(20)23)3-8-24-14/h3,8,10-11H,4-7,9H2,1-2H3