dimethyl 3-methyl-5-[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-[1-(o-tolyl)imidazol-2-yl]sulfanylacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[[1-(2-methylphenyl)-2-imidazolyl]thio]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-[[1-(o-tolyl)imidazol-2-yl]thio]acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=C(C(=C(S3)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=C(C(=C(S3)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C21H21N3O5S2/c1-12-7-5-6-8-14(12)24-10-9-22-21(24)30-11-15(25)23-18-16(19(26)28-3)13(2)17(31-18)20(27)29-4/h5-10H,11H2,1-4H3,(H,23,25)