[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: [(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 2-(cyclopropanecarbonylamino)-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylic acid [(1S)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)NC(=O)C4CC4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O[C@@H](C2=CC=CC=C2)C(=O)NC3CC3)NC(=O)C4CC4)C

InChI

InChI=1S/C22H24N2O4S/c1-12-13(2)29-21(24-19(25)15-8-9-15)17(12)22(27)28-18(14-6-4-3-5-7-14)20(26)23-16-10-11-16/h3-7,15-16,18H,8-11H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1