[2-methyl-4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]quinolin-3-yl]methyl ethanoate

Systemtic Name: [2-methyl-4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]quinolin-3-yl]methyl ethanoate Openeye Name: [2-methyl-4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-quinolyl]methyl acetate CAS Name: acetic acid [2-methyl-4-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-3-quinolinyl]methyl ester IUPAC Name: [2-methyl-4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]quinolin-3-yl]methyl acetate Traditional Name: acetic acid [2-methyl-4-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-3-quinolyl]methyl ester Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1COC(=O)C)SC3=NNC(=N3)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1COC(=O)C)SC3=NNC(=N3)C

InChI

InChI=1S/C16H16N4O2S/c1-9-13(8-22-11(3)21)15(23-16-18-10(2)19-20-16)12-6-4-5-7-14(12)17-9/h4-7H,8H2,1-3H3,(H,18,19,20)