dimethyl-[3-[(2S)-4-oxidanyl-5-oxidanylidene-2-thiophen-2-yl-3-thiophen-2-ylcarbonyl-2H-pyrrol-1-yl]propyl]azanium

Systemtic Name: dimethyl-[3-[(2S)-4-oxidanyl-5-oxidanylidene-2-thiophen-2-yl-3-thiophen-2-ylcarbonyl-2H-pyrrol-1-yl]propyl]azanium Openeye Name: 3-[(2S)-4-hydroxy-5-oxo-2-(2-thienyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[(2S)-4-hydroxy-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2-thiophen-2-yl-2H-pyrrol-1-yl]propyl-dimethylammonium IUPAC Name: 3-[(2S)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2-thiophen-2-yl-2H-pyrrol-1-yl]propyl-dimethylazanium Traditional Name: 3-[(5S)-3-hydroxy-2-keto-4-(2-thenoyl)-5-(2-thienyl)-3-pyrrolin-1-yl]propyl-dimethyl-ammonium Formula: C18H21N2O3S2+ MolecularWeight: 377.50094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C(C(=C(C1=O)O)C(=O)C2=CC=CS2)C3=CC=CS3

Isomeric SMILES

C[NH+](C)CCCN1[C@@H](C(=C(C1=O)O)C(=O)C2=CC=CS2)C3=CC=CS3

InChI

InChI=1S/C18H20N2O3S2/c1-19(2)8-5-9-20-15(12-6-3-10-24-12)14(17(22)18(20)23)16(21)13-7-4-11-25-13/h3-4,6-7,10-11,15,22H,5,8-9H2,1-2H3/p+1/t15-/m1/s1