5-(benzotriazol-1-yl)-1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pentan-1-one

Systemtic Name: 5-(benzotriazol-1-yl)-1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pentan-1-one Openeye Name: 5-(benzotriazol-1-yl)-1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pentan-1-one CAS Name: 5-(1-benzotriazolyl)-1-[4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-1-pentanone IUPAC Name: 5-(benzotriazol-1-yl)-1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pentan-1-one Traditional Name: 5-(benzotriazol-1-yl)-1-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]pentan-1-one Formula: C23H27N7OS MolecularWeight: 449.57178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCCCN4C5=CC=CC=C5N=N4

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCCCN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C23H27N7OS/c1-2-17-15-18-22(24-16-25-23(18)32-17)29-13-11-28(12-14-29)21(31)9-5-6-10-30-20-8-4-3-7-19(20)26-27-30/h3-4,7-8,15-16H,2,5-6,9-14H2,1H3