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

Systemtic Name: 6,7-diethoxy-4-[[2-ethyl-3-[(2-thiophen-2-ylethylamino)methyl]phenyl]amino]quinoline-3-carboxamide Openeye Name: 6,7-diethoxy-4-[2-ethyl-3-[[2-(2-thienyl)ethylamino]methyl]anilino]quinoline-3-carboxamide CAS Name: 6,7-diethoxy-4-[2-ethyl-3-[(2-thiophen-2-ylethylamino)methyl]anilino]-3-quinolinecarboxamide IUPAC Name: 6,7-diethoxy-4-[2-ethyl-3-[(2-thiophen-2-ylethylamino)methyl]anilino]quinoline-3-carboxamide Traditional Name: 6,7-diethoxy-4-[2-ethyl-3-[[2-(2-thienyl)ethylamino]methyl]anilino]quinoline-3-carboxamide Formula: C29H34N4O3S MolecularWeight: 518.67026

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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=CS4

Isomeric SMILES

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCC)OCC)C(=O)N)CNCCC4=CC=CS4

InChI

InChI=1S/C29H34N4O3S/c1-4-21-19(17-31-13-12-20-10-8-14-37-20)9-7-11-24(21)33-28-22-15-26(35-5-2)27(36-6-3)16-25(22)32-18-23(28)29(30)34/h7-11,14-16,18,31H,4-6,12-13,17H2,1-3H3,(H2,30,34)(H,32,33)