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

Systemtic Name: methyl 2-azanyl-4-(4-butylphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-amino-4-(4-butylphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-amino-4-(4-butylphenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(4-butylphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-amino-4-(4-butylphenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO2S/c1-4-5-6-12-7-9-13(10-8-12)14-11(2)21-16(18)15(14)17(19)20-3/h7-10H,4-6,18H2,1-3H3