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

Systemtic Name: 1-[6-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]pyridin-3-yl]-3-(3-methoxyphenyl)urea Openeye Name: 1-[6-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-3-pyridyl]-3-(3-methoxyphenyl)urea CAS Name: 1-[6-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-3-pyridinyl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-[6-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]pyridin-3-yl]-3-(3-methoxyphenyl)urea Traditional Name: 1-(3-methoxyphenyl)-3-[6-(4-piperonyloylpiperazino)-3-pyridyl]urea Formula: C25H25N5O5 MolecularWeight: 475.4965

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H25N5O5/c1-33-20-4-2-3-18(14-20)27-25(32)28-19-6-8-23(26-15-19)29-9-11-30(12-10-29)24(31)17-5-7-21-22(13-17)35-16-34-21/h2-8,13-15H,9-12,16H2,1H3,(H2,27,28,32)