3-[(2R)-3-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl]propyl-diethyl-azanium

Systemtic Name: 3-[(2R)-3-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl]propyl-diethyl-azanium Openeye Name: 3-[(2R)-3-(2,4-dimethylthiazole-5-carbonyl)-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]propyl-diethyl-ammonium CAS Name: 3-[(2R)-3-[(2,4-dimethyl-5-thiazolyl)-oxomethyl]-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]propyl-diethylammonium IUPAC Name: 3-[(2R)-3-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]propyl-diethylazanium Traditional Name: 3-[(5R)-4-(2,4-dimethylthiazole-5-carbonyl)-3-hydroxy-2-keto-5-phenyl-3-pyrrolin-1-yl]propyl-diethyl-ammonium Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(C(=C(C1=O)O)C(=O)C2=C(N=C(S2)C)C)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCCN1[C@@H](C(=C(C1=O)O)C(=O)C2=C(N=C(S2)C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3S/c1-5-25(6-2)13-10-14-26-19(17-11-8-7-9-12-17)18(21(28)23(26)29)20(27)22-15(3)24-16(4)30-22/h7-9,11-12,19,28H,5-6,10,13-14H2,1-4H3/p+1/t19-/m1/s1