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

Systemtic Name: 5-(4-methylphenyl)-3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-3-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-(3-methylpiperidino)ethyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)C

Isomeric SMILES

CC1CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H23N3O2S/c1-14-5-7-16(8-6-14)17-12-27-20-19(17)21(26)24(13-22-20)11-18(25)23-9-3-4-15(2)10-23/h5-8,12-13,15H,3-4,9-11H2,1-2H3