6,7-diethoxy-4-[[2-ethyl-3-[(2-pyridin-2-ylethylamino)methyl]phenyl]amino]quinoline-3-carboxamide

Systemtic Name: 6,7-diethoxy-4-[[2-ethyl-3-[(2-pyridin-2-ylethylamino)methyl]phenyl]amino]quinoline-3-carboxamide Openeye Name: 6,7-diethoxy-4-[2-ethyl-3-[[2-(2-pyridyl)ethylamino]methyl]anilino]quinoline-3-carboxamide CAS Name: 6,7-diethoxy-4-[2-ethyl-3-[[2-(2-pyridinyl)ethylamino]methyl]anilino]-3-quinolinecarboxamide IUPAC Name: 6,7-diethoxy-4-[2-ethyl-3-[(2-pyridin-2-ylethylamino)methyl]anilino]quinoline-3-carboxamide Traditional Name: 6,7-diethoxy-4-[2-ethyl-3-[[2-(2-pyridyl)ethylamino]methyl]anilino]quinoline-3-carboxamide Formula: C30H35N5O3 MolecularWeight: 513.6306

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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)CNCCC4=CC=CC=N4

Isomeric SMILES

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCC)OCC)C(=O)N)CNCCC4=CC=CC=N4

InChI

InChI=1S/C30H35N5O3/c1-4-22-20(18-32-15-13-21-11-7-8-14-33-21)10-9-12-25(22)35-29-23-16-27(37-5-2)28(38-6-3)17-26(23)34-19-24(29)30(31)36/h7-12,14,16-17,19,32H,4-6,13,15,18H2,1-3H3,(H2,31,36)(H,34,35)