1-[3-(diethylamino)propyl]-3-[4-(2-methyl-4-nitro-phenoxy)pyridin-2-yl]urea

Systemtic Name: 1-[3-(diethylamino)propyl]-3-[4-(2-methyl-4-nitro-phenoxy)pyridin-2-yl]urea Openeye Name: 1-[3-(diethylamino)propyl]-3-[4-(2-methyl-4-nitro-phenoxy)-2-pyridyl]urea CAS Name: 1-[3-(diethylamino)propyl]-3-[4-(2-methyl-4-nitrophenoxy)-2-pyridinyl]urea IUPAC Name: 1-[3-(diethylamino)propyl]-3-[4-(2-methyl-4-nitrophenoxy)pyridin-2-yl]urea Traditional Name: 1-[3-(diethylamino)propyl]-3-[4-(2-methyl-4-nitro-phenoxy)-2-pyridyl]urea Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)NC1=NC=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)CCCNC(=O)NC1=NC=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C20H27N5O4/c1-4-24(5-2)12-6-10-22-20(26)23-19-14-17(9-11-21-19)29-18-8-7-16(25(27)28)13-15(18)3/h7-9,11,13-14H,4-6,10,12H2,1-3H3,(H2,21,22,23,26)