1-[3-[4-chloranyl-2-[(5-cyanopyridin-2-yl)carbamoylamino]phenoxy]propyl]-3-[3-(dimethylamino)propyl]urea

Systemtic Name: 1-[3-[4-chloranyl-2-[(5-cyanopyridin-2-yl)carbamoylamino]phenoxy]propyl]-3-[3-(dimethylamino)propyl]urea Openeye Name: 1-[3-[4-chloro-2-[(5-cyano-2-pyridyl)carbamoylamino]phenoxy]propyl]-3-[3-(dimethylamino)propyl]urea CAS Name: 1-[3-[4-chloro-2-[[[(5-cyano-2-pyridinyl)amino]-oxomethyl]amino]phenoxy]propyl]-3-[3-(dimethylamino)propyl]urea IUPAC Name: 1-[3-[4-chloro-2-[(5-cyanopyridin-2-yl)carbamoylamino]phenoxy]propyl]-3-[3-(dimethylamino)propyl]urea Traditional Name: 1-[3-[4-chloro-2-[(5-cyano-2-pyridyl)carbamoylamino]phenoxy]propyl]-3-[3-(dimethylamino)propyl]urea Formula: C22H28ClN7O3 MolecularWeight: 473.95582

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)NCCCOC1=C(C=C(C=C1)Cl)NC(=O)NC2=NC=C(C=C2)C#N

Isomeric SMILES

CN(C)CCCNC(=O)NCCCOC1=C(C=C(C=C1)Cl)NC(=O)NC2=NC=C(C=C2)C#N

InChI

InChI=1S/C22H28ClN7O3/c1-30(2)11-3-9-25-21(31)26-10-4-12-33-19-7-6-17(23)13-18(19)28-22(32)29-20-8-5-16(14-24)15-27-20/h5-8,13,15H,3-4,9-12H2,1-2H3,(H2,25,26,31)(H2,27,28,29,32)