[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-3-pyridyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-pyridinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-pyridyl]-[4-(2-pyridyl)piperazino]methanone Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(N=CC=C3)SC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(N=CC=C3)SC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H22N4O3S/c28-23(27-12-10-26(11-13-27)21-5-1-2-8-24-21)18-4-3-9-25-22(18)31-17-6-7-19-20(16-17)30-15-14-29-19/h1-9,16H,10-15H2