1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-6-indol-1-yl-hexan-1-one

Systemtic Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-6-indol-1-yl-hexan-1-one Openeye Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-6-indol-1-yl-hexan-1-one CAS Name: 1-[4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-6-(1-indolyl)-1-hexanone IUPAC Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-6-indol-1-ylhexan-1-one Traditional Name: 1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-6-indol-1-yl-hexan-1-one Formula: C26H31N5OS MolecularWeight: 461.62224

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCCCCN4C=CC5=CC=CC=C54

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCCCCN4C=CC5=CC=CC=C54

InChI

InChI=1S/C26H31N5OS/c1-2-21-18-22-25(27-19-28-26(22)33-21)31-16-14-30(15-17-31)24(32)10-4-3-7-12-29-13-11-20-8-5-6-9-23(20)29/h5-6,8-9,11,13,18-19H,2-4,7,10,12,14-17H2,1H3