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

Systemtic Name: ethyl 2-[5-[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2-[5-[2-(2-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]acetate CAS Name: 2-[5-[[2-(2-methoxyphenyl)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[2-(2-methoxyphenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]acetate Traditional Name: 2-[5-[[2-keto-2-(2-methoxyphenyl)ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]acetic acid ethyl ester Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(N1C)SCC(=O)C2=CC=CC=C2OC

Isomeric SMILES

CCOC(=O)CC1=NN=C(N1C)SCC(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C16H19N3O4S/c1-4-23-15(21)9-14-17-18-16(19(14)2)24-10-12(20)11-7-5-6-8-13(11)22-3/h5-8H,4,9-10H2,1-3H3