3-ethyl-2-[1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-ethyl-2-[1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-ethyl-2-[1-methyl-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-ethyl-2-[[1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-ethyl-2-[1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-2-[[2-keto-1-methyl-2-(4-methylpiperidino)ethyl]thio]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H25N3O2S3 MolecularWeight: 447.6371

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SC(C)C(=O)N3CCC(CC3)C)SC=C2C4=CC=CS4

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SC(C)C(=O)N3CCC(CC3)C)SC=C2C4=CC=CS4

InChI

InChI=1S/C21H25N3O2S3/c1-4-24-20(26)17-15(16-6-5-11-27-16)12-28-18(17)22-21(24)29-14(3)19(25)23-9-7-13(2)8-10-23/h5-6,11-14H,4,7-10H2,1-3H3