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

Systemtic Name: methyl 2-[[5-[(4-ethoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[5-[(4-ethoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-[(4-ethoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[5-[(4-ethoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-(4-ethoxybenzyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetic acid methyl ester Formula: C15H19N3O3S MolecularWeight: 321.39466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=NN=C(N2C)SCC(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=NN=C(N2C)SCC(=O)OC

InChI

InChI=1S/C15H19N3O3S/c1-4-21-12-7-5-11(6-8-12)9-13-16-17-15(18(13)2)22-10-14(19)20-3/h5-8H,4,9-10H2,1-3H3