[(2R)-3-methyl-1-oxidanylidene-1-(phenethylamino)butan-2-yl] 4-propan-2-ylthieno[3,2-b]pyrrole-5-carboxylate

Systemtic Name: [(2R)-3-methyl-1-oxidanylidene-1-(phenethylamino)butan-2-yl] 4-propan-2-ylthieno[3,2-b]pyrrole-5-carboxylate Openeye Name: [(1R)-2-methyl-1-(phenethylcarbamoyl)propyl] 4-isopropylthieno[3,2-b]pyrrole-5-carboxylate CAS Name: 4-propan-2-yl-5-thieno[3,2-b]pyrrolecarboxylic acid [(2R)-3-methyl-1-oxo-1-(phenethylamino)butan-2-yl] ester IUPAC Name: [(2R)-3-methyl-1-oxo-1-(phenethylamino)butan-2-yl] 4-propan-2-ylthieno[3,2-b]pyrrole-5-carboxylate Traditional Name: 4-isopropylthieno[3,2-b]pyrrole-5-carboxylic acid [(1R)-2-methyl-1-(phenethylcarbamoyl)propyl] ester Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC3=C(N2C(C)C)C=CS3

Isomeric SMILES

CC(C)[C@H](C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC3=C(N2C(C)C)C=CS3

InChI

InChI=1S/C23H28N2O3S/c1-15(2)21(22(26)24-12-10-17-8-6-5-7-9-17)28-23(27)19-14-20-18(11-13-29-20)25(19)16(3)4/h5-9,11,13-16,21H,10,12H2,1-4H3,(H,24,26)/t21-/m1/s1