N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-3-ium-2-yl]-4,5-dihydro-1H-imidazole-2-carboxamide

Systemtic Name: N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-3-ium-2-yl]-4,5-dihydro-1H-imidazole-2-carboxamide Openeye Name: N-[5-[(4-ethylphenyl)methyl]thiazol-3-ium-2-yl]-4,5-dihydro-1H-imidazole-2-carboxamide CAS Name: N-[5-[(4-ethylphenyl)methyl]-2-thiazol-3-iumyl]-4,5-dihydro-1H-imidazole-2-carboxamide IUPAC Name: N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-3-ium-2-yl]-4,5-dihydro-1H-imidazole-2-carboxamide Traditional Name: N-[5-(4-ethylbenzyl)thiazol-3-ium-2-yl]-2-imidazoline-2-carboxamide Formula: C16H19N4OS+ MolecularWeight: 315.41326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=C[NH+]=C(S2)NC(=O)C3=NCCN3

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=C[NH+]=C(S2)NC(=O)C3=NCCN3

InChI

InChI=1S/C16H18N4OS/c1-2-11-3-5-12(6-4-11)9-13-10-19-16(22-13)20-15(21)14-17-7-8-18-14/h3-6,10H,2,7-9H2,1H3,(H,17,18)(H,19,20,21)/p+1