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

Systemtic Name: ethyl 2-[1-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2-[1-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]acetate CAS Name: 2-[1-[[(4-methoxyphenyl)methyl-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[[(4-methoxyphenyl)methyl-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]acetate Traditional Name: 2-[4-methyl-1-[[methyl(p-anisyl)amino]methyl]-5-thioxo-1,2,4-triazol-3-yl]acetic acid ethyl ester Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=S)N1C)CN(C)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)CC1=NN(C(=S)N1C)CN(C)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H24N4O3S/c1-5-24-16(22)10-15-18-21(17(25)20(15)3)12-19(2)11-13-6-8-14(23-4)9-7-13/h6-9H,5,10-12H2,1-4H3