ethyl 2-azanyl-4-(4-butylphenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(4-butylphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-amino-4-(4-butylphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-amino-4-(4-butylphenyl)-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(4-butylphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-amino-4-(4-butylphenyl)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H23NO2S MolecularWeight: 317.44572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)N)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)N)C

InChI

InChI=1S/C18H23NO2S/c1-4-6-7-13-8-10-14(11-9-13)15-12(3)22-17(19)16(15)18(20)21-5-2/h8-11H,4-7,19H2,1-3H3