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

Systemtic Name: 6,7-diethoxy-4-[[2-methyl-3-(1,2,4-triazol-4-ylmethyl)phenyl]amino]quinoline-3-carboxamide Openeye Name: 6,7-diethoxy-4-[2-methyl-3-(1,2,4-triazol-4-ylmethyl)anilino]quinoline-3-carboxamide CAS Name: 6,7-diethoxy-4-[2-methyl-3-(1,2,4-triazol-4-ylmethyl)anilino]-3-quinolinecarboxamide IUPAC Name: 6,7-diethoxy-4-[2-methyl-3-(1,2,4-triazol-4-ylmethyl)anilino]quinoline-3-carboxamide Traditional Name: 6,7-diethoxy-4-[2-methyl-3-(1,2,4-triazol-4-ylmethyl)anilino]quinoline-3-carboxamide Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C(=O)N)NC3=CC=CC(=C3C)CN4C=NN=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C(=O)N)NC3=CC=CC(=C3C)CN4C=NN=C4)OCC

InChI

InChI=1S/C24H26N6O3/c1-4-32-21-9-17-20(10-22(21)33-5-2)26-11-18(24(25)31)23(17)29-19-8-6-7-16(15(19)3)12-30-13-27-28-14-30/h6-11,13-14H,4-5,12H2,1-3H3,(H2,25,31)(H,26,29)