1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-(1-phenylimidazol-2-yl)sulfanyl-butan-1-one

Systemtic Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-(1-phenylimidazol-2-yl)sulfanyl-butan-1-one Openeye Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-(1-phenylimidazol-2-yl)sulfanyl-butan-1-one CAS Name: 1-[4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-4-[(1-phenyl-2-imidazolyl)thio]-1-butanone IUPAC Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-(1-phenylimidazol-2-yl)sulfanylbutan-1-one Traditional Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-4-[(1-phenylimidazol-2-yl)thio]butan-1-one Formula: C25H28N6OS2 MolecularWeight: 492.65942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCCSC4=NC=CN4C5=CC=CC=C5

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCCSC4=NC=CN4C5=CC=CC=C5

InChI

InChI=1S/C25H28N6OS2/c1-2-20-17-21-23(27-18-28-24(21)34-20)30-14-12-29(13-15-30)22(32)9-6-16-33-25-26-10-11-31(25)19-7-4-3-5-8-19/h3-5,7-8,10-11,17-18H,2,6,9,12-16H2,1H3