methyl 3-[[4-(3-methylbutoxy)phenyl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(3-methylbutoxy)phenyl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(4-isopentyloxybenzoyl)amino]thiophene-2-carboxylate CAS Name: 3-[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(3-methylbutoxy)benzoyl]amino]thiophene-2-carboxylate Traditional Name: 3-[(4-isoamoxybenzoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C18H21NO4S/c1-12(2)8-10-23-14-6-4-13(5-7-14)17(20)19-15-9-11-24-16(15)18(21)22-3/h4-7,9,11-12H,8,10H2,1-3H3,(H,19,20)