3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-methyl-5-piperidin-1-ylsulfonyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-methyl-5-piperidin-1-ylsulfonyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-6-methyl-5-(1-piperidylsulfonyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-6-methyl-5-(1-piperidinylsulfonyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-6-methyl-5-piperidin-1-ylsulfonylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl]-6-methyl-5-piperidinosulfonyl-thieno[2,3-d]pyrimidin-4-one Formula: C25H31N5O5S2 MolecularWeight: 545.67414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C25H31N5O5S2/c1-18-23(37(33,34)30-10-4-3-5-11-30)22-24(36-18)26-17-29(25(22)32)16-21(31)28-14-12-27(13-15-28)19-6-8-20(35-2)9-7-19/h6-9,17H,3-5,10-16H2,1-2H3