1-[2-(dibutylamino)ethyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]urea

Systemtic Name: 1-[2-(dibutylamino)ethyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]urea Openeye Name: 1-[2-(dibutylamino)ethyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]urea CAS Name: 1-[2-(dibutylamino)ethyl]-3-[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]-2-nitrophenyl]urea IUPAC Name: 1-[2-(dibutylamino)ethyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea Traditional Name: 1-[2-(dibutylamino)ethyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]urea Formula: C27H36N6O6 MolecularWeight: 540.61134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCNC(=O)NC1=C(C=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC)CCNC(=O)NC1=C(C=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C27H36N6O6/c1-5-7-12-32(13-8-6-2)14-11-28-27(34)31-21-10-9-19(15-23(21)33(35)36)39-26-20-16-24(37-3)25(38-4)17-22(20)29-18-30-26/h9-10,15-18H,5-8,11-14H2,1-4H3,(H2,28,31,34)