1-[6-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]pyridin-3-yl]-3-(2-ethoxyphenyl)urea

Systemtic Name: 1-[6-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]pyridin-3-yl]-3-(2-ethoxyphenyl)urea Openeye Name: 1-[6-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-3-pyridyl]-3-(2-ethoxyphenyl)urea CAS Name: 1-[6-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-3-pyridinyl]-3-(2-ethoxyphenyl)urea IUPAC Name: 1-[6-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]pyridin-3-yl]-3-(2-ethoxyphenyl)urea Traditional Name: 1-o-phenetyl-3-[6-(4-piperonyloylpiperazino)-3-pyridyl]urea Formula: C26H27N5O5 MolecularWeight: 489.52308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H27N5O5/c1-2-34-21-6-4-3-5-20(21)29-26(33)28-19-8-10-24(27-16-19)30-11-13-31(14-12-30)25(32)18-7-9-22-23(15-18)36-17-35-22/h3-10,15-16H,2,11-14,17H2,1H3,(H2,28,29,33)