5-(4-ethoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-ethoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-ethoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-ethoxyphenyl)-3-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-ethoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-(4-methylpiperazino)ethyl]-5-p-phenetyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)N4CCN(CC4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)N4CCN(CC4)C

InChI

InChI=1S/C21H24N4O3S/c1-3-28-16-6-4-15(5-7-16)17-13-29-20-19(17)21(27)25(14-22-20)12-18(26)24-10-8-23(2)9-11-24/h4-7,13-14H,3,8-12H2,1-2H3