N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-6-methoxy-2-methyl-quinoline-3-carboxamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-6-methoxy-2-methyl-quinoline-3-carboxamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-6-methoxy-2-methyl-quinoline-3-carboxamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-6-methoxy-2-methyl-3-quinolinecarboxamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-6-methoxy-2-methylquinoline-3-carboxamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-6-methoxy-2-methyl-quinoline-3-carboxamide Formula: C22H19BrN4O2 MolecularWeight: 451.31586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H19BrN4O2/c1-14-19(12-16-11-18(29-2)7-8-20(16)25-14)22(28)26-21-9-10-24-27(21)13-15-3-5-17(23)6-4-15/h3-12H,13H2,1-2H3,(H,26,28)