5-azanyl-4-(4-phenyl-1,3-thiazol-2-yl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-(4-phenyl-1,3-thiazol-2-yl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2H-pyrrol-3-one Openeye Name: 5-amino-4-(4-phenylthiazol-2-yl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2H-pyrrol-3-one CAS Name: 5-amino-4-(4-phenyl-2-thiazolyl)-1-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-2H-pyrrol-3-one IUPAC Name: 5-amino-4-(4-phenyl-1,3-thiazol-2-yl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2H-pyrrol-3-one Traditional Name: 5-amino-4-(4-phenylthiazol-2-yl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2-pyrrolin-3-one Formula: C22H29N4OS+ MolecularWeight: 397.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)N2CC(=O)C(=C2N)C3=NC(=CS3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)N2CC(=O)C(=C2N)C3=NC(=CS3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H28N4OS/c1-21(2)10-15(11-22(3,4)25-21)26-12-17(27)18(19(26)23)20-24-16(13-28-20)14-8-6-5-7-9-14/h5-9,13,15,25H,10-12,23H2,1-4H3/p+1