1-(azepan-1-yl)-2-[4-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[4-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[4-[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[4-(2-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[4-(2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[4-[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]piperazino]ethanone Formula: C23H29N5OS2 MolecularWeight: 455.63926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)N4CCN(CC4)CC(=O)N5CCCCCC5

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)N4CCN(CC4)CC(=O)N5CCCCCC5

InChI

InChI=1S/C23H29N5OS2/c1-17-24-22(21-18(16-31-23(21)25-17)19-7-6-14-30-19)28-12-10-26(11-13-28)15-20(29)27-8-4-2-3-5-9-27/h6-7,14,16H,2-5,8-13,15H2,1H3