diethyl-[(1S)-1-(3-methoxyphenyl)-2-[3-(thiophen-3-ylcarbonylamino)propanoylamino]ethyl]azanium

Systemtic Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-[3-(thiophen-3-ylcarbonylamino)propanoylamino]ethyl]azanium Openeye Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-[3-(thiophene-3-carbonylamino)propanoylamino]ethyl]ammonium CAS Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]amino]ethyl]ammonium IUPAC Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-[3-(thiophene-3-carbonylamino)propanoylamino]ethyl]azanium Traditional Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-[3-(3-thenoylamino)propanoylamino]ethyl]ammonium Formula: C21H30N3O3S+ MolecularWeight: 404.5462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)CCNC(=O)C1=CSC=C1)C2=CC(=CC=C2)OC

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)CCNC(=O)C1=CSC=C1)C2=CC(=CC=C2)OC

InChI

InChI=1S/C21H29N3O3S/c1-4-24(5-2)19(16-7-6-8-18(13-16)27-3)14-23-20(25)9-11-22-21(26)17-10-12-28-15-17/h6-8,10,12-13,15,19H,4-5,9,11,14H2,1-3H3,(H,22,26)(H,23,25)/p+1/t19-/m1/s1