[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(cyclopropylcarbonylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(cyclopropylcarbonylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 2-(cyclopropanecarbonylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-4-phenyl-3-thiophenecarboxylic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-(cyclopropanecarbonylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(cyclopropanecarbonylamino)-4-phenyl-thiophene-3-carboxylic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C2=C(SC=C2C3=CC=CC=C3)NC(=O)C4CC4

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)C2=C(SC=C2C3=CC=CC=C3)NC(=O)C4CC4

InChI

InChI=1S/C21H22N2O4S/c1-12(18(24)22-15-9-10-15)27-21(26)17-16(13-5-3-2-4-6-13)11-28-20(17)23-19(25)14-7-8-14/h2-6,11-12,14-15H,7-10H2,1H3,(H,22,24)(H,23,25)/t12-/m1/s1