5,6-dimethyl-3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[3-keto-3-(4-phenylpiperazino)propyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)N3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)N3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H24N4O2S/c1-15-16(2)28-20-19(15)21(27)25(14-22-20)9-8-18(26)24-12-10-23(11-13-24)17-6-4-3-5-7-17/h3-7,14H,8-13H2,1-2H3