(3-methoxycarbonylphenyl)methyl 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: (3-methoxycarbonylphenyl)methyl 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 2-(cyclopropanecarbonylamino)-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylic acid (3-carbomethoxybenzyl) ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=CC=CC(=C2)C(=O)OC)NC(=O)C3CC3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=CC=CC(=C2)C(=O)OC)NC(=O)C3CC3)C

InChI

InChI=1S/C20H21NO5S/c1-11-12(2)27-18(21-17(22)14-7-8-14)16(11)20(24)26-10-13-5-4-6-15(9-13)19(23)25-3/h4-6,9,14H,7-8,10H2,1-3H3,(H,21,22)