5-(4-methylphenyl)-3-[3-(4-methylpiperidin-1-yl)-3-oxidanylidene-propyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-methylphenyl)-3-[3-(4-methylpiperidin-1-yl)-3-oxidanylidene-propyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[3-(4-methyl-1-piperidyl)-3-oxo-propyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-3-[3-(4-methyl-1-piperidinyl)-3-oxopropyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-3-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[3-keto-3-(4-methylpiperidino)propyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CCN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)C

Isomeric SMILES

CC1CCN(CC1)C(=O)CCN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H25N3O2S/c1-15-3-5-17(6-4-15)18-13-28-21-20(18)22(27)25(14-23-21)12-9-19(26)24-10-7-16(2)8-11-24/h3-6,13-14,16H,7-12H2,1-2H3