5-ethyl-6-methyl-2-[4-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-ethyl-6-methyl-2-[4-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-ethyl-6-methyl-2-[4-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-2-[4-[oxo-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]methyl]phenyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-ethyl-6-methyl-2-[4-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-ethyl-6-methyl-2-[4-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C29H32N4O4S2 MolecularWeight: 564.71878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=NC5=C(C(=C(S5)C)CC)C(=O)N4

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=NC5=C(C(=C(S5)C)CC)C(=O)N4

InChI

InChI=1S/C29H32N4O4S2/c1-4-6-20-7-13-23(14-8-20)39(36,37)33-17-15-32(16-18-33)29(35)22-11-9-21(10-12-22)26-30-27(34)25-24(5-2)19(3)38-28(25)31-26/h7-14H,4-6,15-18H2,1-3H3,(H,30,31,34)