6-methoxy-2-methyl-N-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]quinoline-3-carboxamide

Systemtic Name: 6-methoxy-2-methyl-N-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]quinoline-3-carboxamide Openeye Name: 6-methoxy-2-methyl-N-[[2-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]quinoline-3-carboxamide CAS Name: 6-methoxy-2-methyl-N-[[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]-3-quinolinecarboxamide IUPAC Name: 6-methoxy-2-methyl-N-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]quinoline-3-carboxamide Traditional Name: 6-methoxy-2-methyl-N-[[2-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]quinoline-3-carboxamide Formula: C20H18N6O2 MolecularWeight: 374.39592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)NCC3=C(N=CC=C3)N4C=NC=N4

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)NCC3=C(N=CC=C3)N4C=NC=N4

InChI

InChI=1S/C20H18N6O2/c1-13-17(9-15-8-16(28-2)5-6-18(15)25-13)20(27)23-10-14-4-3-7-22-19(14)26-12-21-11-24-26/h3-9,11-12H,10H2,1-2H3,(H,23,27)