ethyl 4,5-dimethyl-2-[[5-(phenylmethyl)furan-2-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[[5-(phenylmethyl)furan-2-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-benzylfuran-2-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[oxo-[5-(phenylmethyl)-2-furanyl]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-benzylfuran-2-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(5-benzyl-2-furoyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC=C(O2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC=C(O2)CC3=CC=CC=C3

InChI

InChI=1S/C21H21NO4S/c1-4-25-21(24)18-13(2)14(3)27-20(18)22-19(23)17-11-10-16(26-17)12-15-8-6-5-7-9-15/h5-11H,4,12H2,1-3H3,(H,22,23)