2-[3-methyl-1-(4-methylpiperazin-1-yl)butyl]-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[3-methyl-1-(4-methylpiperazin-1-yl)butyl]-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-benzyl-2-[3-methyl-1-(4-methylpiperazin-1-yl)butyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[3-methyl-1-(4-methyl-1-piperazinyl)butyl]-3-(phenylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-benzyl-2-[3-methyl-1-(4-methylpiperazin-1-yl)butyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-benzyl-2-[3-methyl-1-(4-methylpiperazino)butyl]thieno[2,3-d]pyrimidin-4-one Formula: C23H30N4OS MolecularWeight: 410.5755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC2=C(C=CS2)C(=O)N1CC3=CC=CC=C3)N4CCN(CC4)C

Isomeric SMILES

CC(C)CC(C1=NC2=C(C=CS2)C(=O)N1CC3=CC=CC=C3)N4CCN(CC4)C

InChI

InChI=1S/C23H30N4OS/c1-17(2)15-20(26-12-10-25(3)11-13-26)21-24-22-19(9-14-29-22)23(28)27(21)16-18-7-5-4-6-8-18/h4-9,14,17,20H,10-13,15-16H2,1-3H3