[2-[1,4-dioxan-2-ylmethyl(methyl)amino]-6-thiophen-2-yl-pyridin-3-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone

Systemtic Name: [2-[1,4-dioxan-2-ylmethyl(methyl)amino]-6-thiophen-2-yl-pyridin-3-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Openeye Name: [2-[1,4-dioxan-2-ylmethyl(methyl)amino]-6-(2-thienyl)-3-pyridyl]-[4-(1-piperidyl)-1-piperidyl]methanone CAS Name: [2-[1,4-dioxan-2-ylmethyl(methyl)amino]-6-thiophen-2-yl-3-pyridinyl]-[4-(1-piperidinyl)-1-piperidinyl]methanone IUPAC Name: [2-[1,4-dioxan-2-ylmethyl(methyl)amino]-6-thiophen-2-ylpyridin-3-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Traditional Name: [2-[1,4-dioxan-2-ylmethyl(methyl)amino]-6-(2-thienyl)-3-pyridyl]-(4-piperidinopiperidino)methanone Formula: C26H36N4O3S MolecularWeight: 484.65404

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COCCO1)C2=C(C=CC(=N2)C3=CC=CS3)C(=O)N4CCC(CC4)N5CCCCC5

Isomeric SMILES

CN(CC1COCCO1)C2=C(C=CC(=N2)C3=CC=CS3)C(=O)N4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C26H36N4O3S/c1-28(18-21-19-32-15-16-33-21)25-22(7-8-23(27-25)24-6-5-17-34-24)26(31)30-13-9-20(10-14-30)29-11-3-2-4-12-29/h5-8,17,20-21H,2-4,9-16,18-19H2,1H3