3-(thiophen-2-ylmethyl)-2-[(2,4,6-trimethylphenyl)amino]-1,5-dihydroimidazol-3-ium-4-one

Systemtic Name: 3-(thiophen-2-ylmethyl)-2-[(2,4,6-trimethylphenyl)amino]-1,5-dihydroimidazol-3-ium-4-one Openeye Name: 3-(2-thienylmethyl)-2-(2,4,6-trimethylanilino)-1,5-dihydroimidazol-3-ium-4-one CAS Name: 3-(thiophen-2-ylmethyl)-2-(2,4,6-trimethylanilino)-1,5-dihydroimidazol-3-ium-4-one IUPAC Name: 3-(thiophen-2-ylmethyl)-2-(2,4,6-trimethylanilino)-1,5-dihydroimidazol-3-ium-4-one Traditional Name: 2-mesidino-3-(2-thenyl)-2-imidazolin-3-ium-4-one Formula: C17H20N3OS+ MolecularWeight: 314.4252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC2=[N+](C(=O)CN2)CC3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC2=[N+](C(=O)CN2)CC3=CC=CS3)C

InChI

InChI=1S/C17H19N3OS/c1-11-7-12(2)16(13(3)8-11)19-17-18-9-15(21)20(17)10-14-5-4-6-22-14/h4-8H,9-10H2,1-3H3,(H,18,19)/p+1