diethyl-[(2S)-1-phenyl-3-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]propan-2-yl]azanium

Systemtic Name: diethyl-[(2S)-1-phenyl-3-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[[4-(thiophene-2-carbonylamino)benzoyl]amino]ethyl]-diethyl-ammonium CAS Name: diethyl-[(2S)-1-[[oxo-[4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]methyl]amino]-3-phenylpropan-2-yl]ammonium IUPAC Name: diethyl-[(2S)-1-phenyl-3-[[4-(thiophene-2-carbonylamino)benzoyl]amino]propan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-[[4-(2-thenoylamino)benzoyl]amino]ethyl]-diethyl-ammonium Formula: C25H30N3O2S+ MolecularWeight: 436.5896

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CC1=CC=CC=C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC[NH+](CC)[C@@H](CC1=CC=CC=C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C25H29N3O2S/c1-3-28(4-2)22(17-19-9-6-5-7-10-19)18-26-24(29)20-12-14-21(15-13-20)27-25(30)23-11-8-16-31-23/h5-16,22H,3-4,17-18H2,1-2H3,(H,26,29)(H,27,30)/p+1/t22-/m0/s1