6,7-diethoxy-4-[[2-ethyl-3-(imidazol-1-ylmethyl)phenyl]amino]quinoline-3-carboxamide

Systemtic Name: 6,7-diethoxy-4-[[2-ethyl-3-(imidazol-1-ylmethyl)phenyl]amino]quinoline-3-carboxamide Openeye Name: 6,7-diethoxy-4-[2-ethyl-3-(imidazol-1-ylmethyl)anilino]quinoline-3-carboxamide CAS Name: 6,7-diethoxy-4-[2-ethyl-3-(1-imidazolylmethyl)anilino]-3-quinolinecarboxamide IUPAC Name: 6,7-diethoxy-4-[2-ethyl-3-(imidazol-1-ylmethyl)anilino]quinoline-3-carboxamide Traditional Name: 6,7-diethoxy-4-[2-ethyl-3-(imidazol-1-ylmethyl)anilino]quinoline-3-carboxamide Formula: C26H29N5O3 MolecularWeight: 459.54016

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCC)OCC)C(=O)N)CN4C=CN=C4

Isomeric SMILES

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCC)OCC)C(=O)N)CN4C=CN=C4

InChI

InChI=1S/C26H29N5O3/c1-4-18-17(15-31-11-10-28-16-31)8-7-9-21(18)30-25-19-12-23(33-5-2)24(34-6-3)13-22(19)29-14-20(25)26(27)32/h7-14,16H,4-6,15H2,1-3H3,(H2,27,32)(H,29,30)