N-ethylethanamine; 1-phenyl-3-quinolin-4-yl-urea; dihydrochloride

Systemtic Name: N-ethylethanamine; 1-phenyl-3-quinolin-4-yl-urea; dihydrochloride Openeye Name: N-ethylethanamine; 1-phenyl-3-(4-quinolyl)urea; dihydrochloride CAS Name: N-ethylethanamine; 1-phenyl-3-(4-quinolinyl)urea; dihydrochloride IUPAC Name: N-ethylethanamine; 1-phenyl-3-quinolin-4-ylurea; dihydrochloride Traditional Name: diethylamine; 1-phenyl-3-(4-quinolyl)urea; dihydrochloride Formula: C20H26Cl2N4O MolecularWeight: 409.35264

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC.C1=CC=C(C=C1)NC(=O)NC2=CC=NC3=CC=CC=C32.Cl.Cl

Isomeric SMILES

CCNCC.C1=CC=C(C=C1)NC(=O)NC2=CC=NC3=CC=CC=C32.Cl.Cl

InChI

InChI=1S/C16H13N3O.C4H11N.2ClH/c20-16(18-12-6-2-1-3-7-12)19-15-10-11-17-14-9-5-4-8-13(14)15;1-3-5-4-2;;/h1-11H,(H2,17,18,19,20);5H,3-4H2,1-2H3;2*1H