7-methoxy-2-methyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]quinoline-3-carboxamide

Systemtic Name: 7-methoxy-2-methyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]quinoline-3-carboxamide Openeye Name: 7-methoxy-2-methyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]quinoline-3-carboxamide CAS Name: 7-methoxy-2-methyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-3-quinolinecarboxamide IUPAC Name: 7-methoxy-2-methyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]quinoline-3-carboxamide Traditional Name: 7-methoxy-2-methyl-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]quinoline-3-carboxamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C22H21N5O2/c1-15-20(9-18-7-8-19(29-2)10-21(18)26-15)22(28)24-11-16-3-5-17(6-4-16)12-27-14-23-13-25-27/h3-10,13-14H,11-12H2,1-2H3,(H,24,28)