[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-(5-methyl-2-thiophen-2-yl-1H-indol-3-yl)propanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-(5-methyl-2-thiophen-2-yl-1H-indol-3-yl)propanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 3-[5-methyl-2-(2-thienyl)-1H-indol-3-yl]propanoate CAS Name: 3-(5-methyl-2-thiophen-2-yl-1H-indol-3-yl)propanoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 3-(5-methyl-2-thiophen-2-yl-1H-indol-3-yl)propanoate Traditional Name: 3-[5-methyl-2-(2-thienyl)-1H-indol-3-yl]propionic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)CCC1=C(NC2=C1C=C(C=C2)C)C3=CC=CS3

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)CCC1=C(NC2=C1C=C(C=C2)C)C3=CC=CS3

InChI

InChI=1S/C21H24N2O3S/c1-4-22-21(25)14(3)26-19(24)10-8-15-16-12-13(2)7-9-17(16)23-20(15)18-6-5-11-27-18/h5-7,9,11-12,14,23H,4,8,10H2,1-3H3,(H,22,25)/t14-/m0/s1