4-[(2-ethylphenyl)amino]-7-methoxy-6-(2-thiophen-3-ylethoxy)quinoline-3-carboxamide

Systemtic Name: 4-[(2-ethylphenyl)amino]-7-methoxy-6-(2-thiophen-3-ylethoxy)quinoline-3-carboxamide Openeye Name: 4-(2-ethylanilino)-7-methoxy-6-[2-(3-thienyl)ethoxy]quinoline-3-carboxamide CAS Name: 4-(2-ethylanilino)-7-methoxy-6-[2-(3-thiophenyl)ethoxy]-3-quinolinecarboxamide IUPAC Name: 4-(2-ethylanilino)-7-methoxy-6-(2-thiophen-3-ylethoxy)quinoline-3-carboxamide Traditional Name: 4-(2-ethylanilino)-7-methoxy-6-[2-(3-thienyl)ethoxy]quinoline-3-carboxamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCCC4=CSC=C4)OC)C(=O)N

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCCC4=CSC=C4)OC)C(=O)N

InChI

InChI=1S/C25H25N3O3S/c1-3-17-6-4-5-7-20(17)28-24-18-12-23(31-10-8-16-9-11-32-15-16)22(30-2)13-21(18)27-14-19(24)25(26)29/h4-7,9,11-15H,3,8,10H2,1-2H3,(H2,26,29)(H,27,28)