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

Systemtic Name: dimethyl 5-azanyl-3-[[1-(3-methylphenyl)imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[1-(m-tolyl)imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[1-(3-methylphenyl)-2-imidazolyl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[1-(3-methylphenyl)imidazol-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[[1-(m-tolyl)imidazol-2-yl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN=C2SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN=C2SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C19H19N3O4S2/c1-11-5-4-6-12(9-11)22-8-7-21-19(22)27-10-13-14(17(23)25-2)16(20)28-15(13)18(24)26-3/h4-9H,10,20H2,1-3H3