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

Systemtic Name: 5-methyl-6-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-methyl-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-[2-oxo-2-(1-piperidyl)ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-6-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-3-[2-oxo-2-(1-piperidinyl)ethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-methyl-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-(2-oxo-2-piperidin-1-ylethyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-keto-2-piperidino-ethyl)-5-methyl-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]thieno[2,3-d]pyrimidin-4-one Formula: C25H28N6O5S MolecularWeight: 524.59202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCCC3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCCC3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H28N6O5S/c1-17-21-23(26-16-30(24(21)33)15-20(32)28-9-3-2-4-10-28)37-22(17)25(34)29-13-11-27(12-14-29)18-5-7-19(8-6-18)31(35)36/h5-8,16H,2-4,9-15H2,1H3