dimethyl 3-methyl-5-[2-[(4-propyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-[(4-propyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-[[4-propyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[(4-propyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-[(4-propyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-[[4-propyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H22N4O5S3 MolecularWeight: 494.60748

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC)C3=CC=CS3

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC)C3=CC=CS3

InChI

InChI=1S/C20H22N4O5S3/c1-5-8-24-16(12-7-6-9-30-12)22-23-20(24)31-10-13(25)21-17-14(18(26)28-3)11(2)15(32-17)19(27)29-4/h6-7,9H,5,8,10H2,1-4H3,(H,21,25)