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

Systemtic Name: methyl 2-[[5-[(2-methylquinolin-8-yl)oxymethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[4-allyl-5-[(2-methyl-8-quinolyl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-[(2-methyl-8-quinolinyl)oxymethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[5-[(2-methylquinolin-8-yl)oxymethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-allyl-5-[(2-methyl-8-quinolyl)oxymethyl]-1,2,4-triazol-3-yl]thio]acetic acid methyl ester Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O3S/c1-4-10-23-16(21-22-19(23)27-12-17(24)25-3)11-26-15-7-5-6-14-9-8-13(2)20-18(14)15/h4-9H,1,10-12H2,2-3H3