6-(azepan-1-ylcarbonyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-(azepan-1-ylcarbonyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-(azepane-1-carbonyl)-5-methyl-3-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 6-[1-azepanyl(oxo)methyl]-5-methyl-3-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-(azepane-1-carbonyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-(azepane-1-carbonyl)-3-[2-keto-2-(3-methylpiperidino)ethyl]-5-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)N4CCCCCC4)C

Isomeric SMILES

CC1CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)N4CCCCCC4)C

InChI

InChI=1S/C22H30N4O3S/c1-15-8-7-11-25(12-15)17(27)13-26-14-23-20-18(21(26)28)16(2)19(30-20)22(29)24-9-5-3-4-6-10-24/h14-15H,3-13H2,1-2H3