2-[[5-[(2-methylquinolin-8-yl)oxymethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[[5-[(2-methylquinolin-8-yl)oxymethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[[4-allyl-5-[(2-methyl-8-quinolyl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-ethanone CAS Name: 2-[[5-[(2-methyl-8-quinolinyl)oxymethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-phenylethanone IUPAC Name: 2-[[5-[(2-methylquinolin-8-yl)oxymethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone Traditional Name: 2-[[4-allyl-5-[(2-methyl-8-quinolyl)oxymethyl]-1,2,4-triazol-3-yl]thio]-1-phenyl-ethanone Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCC3=NN=C(N3CC=C)SCC(=O)C4=CC=CC=C4)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCC3=NN=C(N3CC=C)SCC(=O)C4=CC=CC=C4)C=C1

InChI

InChI=1S/C24H22N4O2S/c1-3-14-28-22(15-30-21-11-7-10-19-13-12-17(2)25-23(19)21)26-27-24(28)31-16-20(29)18-8-5-4-6-9-18/h3-13H,1,14-16H2,2H3