N-[(2-methyl-1,3-thiazol-5-yl)-phenyl-methyl]-3-oxidanyl-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(2-methyl-1,3-thiazol-5-yl)-phenyl-methyl]-3-oxidanyl-2-phenyl-quinoline-4-carboxamide Openeye Name: 3-hydroxy-N-[(2-methylthiazol-5-yl)-phenyl-methyl]-2-phenyl-quinoline-4-carboxamide CAS Name: 3-hydroxy-N-[(2-methyl-5-thiazolyl)-phenylmethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: 3-hydroxy-N-[(2-methyl-1,3-thiazol-5-yl)-phenylmethyl]-2-phenylquinoline-4-carboxamide Traditional Name: 3-hydroxy-N-[(2-methylthiazol-5-yl)-phenyl-methyl]-2-phenyl-cinchoninamide Formula: C27H21N3O2S MolecularWeight: 451.53954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(S1)C(C2=CC=CC=C2)NC(=O)C3=C(C(=NC4=CC=CC=C43)C5=CC=CC=C5)O

Isomeric SMILES

CC1=NC=C(S1)C(C2=CC=CC=C2)NC(=O)C3=C(C(=NC4=CC=CC=C43)C5=CC=CC=C5)O

InChI

InChI=1S/C27H21N3O2S/c1-17-28-16-22(33-17)24(18-10-4-2-5-11-18)30-27(32)23-20-14-8-9-15-21(20)29-25(26(23)31)19-12-6-3-7-13-19/h2-16,24,31H,1H3,(H,30,32)