5-[ethyl-(2-ethylphenyl)amino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: 5-[ethyl-(2-ethylphenyl)amino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: 5-(N,2-diethylanilino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-(N,2-diethylanilino)-3-methylthiophene-2,4-dicarboxylate IUPAC Name: 5-(N,2-diethylanilino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(N,2-diethylanilino)-3-methyl-thiophene-2,4-dicarboxylate Formula: C17H17NO4S-2 MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(CC)C2=C(C(=C(S2)C(=O)[O-])C)C(=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1N(CC)C2=C(C(=C(S2)C(=O)[O-])C)C(=O)[O-]

InChI

InChI=1S/C17H19NO4S/c1-4-11-8-6-7-9-12(11)18(5-2)15-13(16(19)20)10(3)14(23-15)17(21)22/h6-9H,4-5H2,1-3H3,(H,19,20)(H,21,22)/p-2