[2-oxidanylidene-2-[[(2R)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2R)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate Openeye Name: [2-[[(1R)-1-benzyl-2-oxo-propyl]amino]-2-oxo-ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate CAS Name: 5-methyl-4-propyl-2-thiophenecarboxylic acid [2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethyl] 5-methyl-4-propylthiophene-2-carboxylate Traditional Name: 5-methyl-4-propyl-thiophene-2-carboxylic acid [2-[[(1R)-1-benzyl-2-keto-propyl]amino]-2-keto-ethyl] ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=C1)C(=O)OCC(=O)NC(CC2=CC=CC=C2)C(=O)C)C

Isomeric SMILES

CCCC1=C(SC(=C1)C(=O)OCC(=O)N[C@H](CC2=CC=CC=C2)C(=O)C)C

InChI

InChI=1S/C21H25NO4S/c1-4-8-17-12-19(27-15(17)3)21(25)26-13-20(24)22-18(14(2)23)11-16-9-6-5-7-10-16/h5-7,9-10,12,18H,4,8,11,13H2,1-3H3,(H,22,24)/t18-/m1/s1