methyl 3-[2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-oxoethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C19H20N4O4S2 MolecularWeight: 432.5165

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NC(CC(=O)OC)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NC(CC(=O)OC)C3=CC=CS3

InChI

InChI=1S/C19H20N4O4S2/c1-26-13-7-5-12(6-8-13)18-21-22-19(28)23(18)11-16(24)20-14(10-17(25)27-2)15-4-3-9-29-15/h3-9,14H,10-11H2,1-2H3,(H,20,24)(H,22,28)