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

Systemtic Name: dimethyl 5-azanyl-3-[(1-ethylbenzimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(1-ethylbenzimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(1-ethyl-2-benzimidazolyl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(1-ethylbenzimidazol-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(1-ethylbenzimidazol-2-yl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H19N3O4S2 MolecularWeight: 405.49116

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C18H19N3O4S2/c1-4-21-12-8-6-5-7-11(12)20-18(21)26-9-10-13(16(22)24-2)15(19)27-14(10)17(23)25-3/h5-8H,4,9,19H2,1-3H3