1-[1-[4-(oxepin-2-yl)piperazin-1-yl]propan-2-yl]-3-phenyl-1-pyridin-2-yl-urea

Systemtic Name: 1-[1-[4-(oxepin-2-yl)piperazin-1-yl]propan-2-yl]-3-phenyl-1-pyridin-2-yl-urea Openeye Name: 1-[1-methyl-2-[4-(oxepin-2-yl)piperazin-1-yl]ethyl]-3-phenyl-1-(2-pyridyl)urea CAS Name: 1-[1-[4-(2-oxepinyl)-1-piperazinyl]propan-2-yl]-3-phenyl-1-(2-pyridinyl)urea IUPAC Name: 1-[1-[4-(oxepin-2-yl)piperazin-1-yl]propan-2-yl]-3-phenyl-1-pyridin-2-ylurea Traditional Name: 1-[1-methyl-2-[4-(oxepin-2-yl)piperazino]ethyl]-3-phenyl-1-(2-pyridyl)urea Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)C2=CC=CC=CO2)N(C3=CC=CC=N3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(CN1CCN(CC1)C2=CC=CC=CO2)N(C3=CC=CC=N3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O2/c1-21(20-28-15-17-29(18-16-28)24-13-6-3-9-19-32-24)30(23-12-7-8-14-26-23)25(31)27-22-10-4-2-5-11-22/h2-14,19,21H,15-18,20H2,1H3,(H,27,31)