[1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C23H28N6O2S MolecularWeight: 452.57242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C23H28N6O2S/c1-2-31-18-6-7-19-20(15-18)32-23(26-19)29-10-3-5-17(16-29)21(30)27-11-13-28(14-12-27)22-24-8-4-9-25-22/h4,6-9,15,17H,2-3,5,10-14,16H2,1H3