3-azanyl-N-(4-chlorophenyl)-5-methyl-N'-[[(2R)-oxolan-2-yl]methyl]-1,2-thiazol-2-ium-2-carboximidamide

Systemtic Name: 3-azanyl-N-(4-chlorophenyl)-5-methyl-N'-[[(2R)-oxolan-2-yl]methyl]-1,2-thiazol-2-ium-2-carboximidamide Openeye Name: 3-amino-N-(4-chlorophenyl)-5-methyl-N'-[[(2R)-tetrahydrofuran-2-yl]methyl]isothiazol-2-ium-2-carboxamidine CAS Name: 3-amino-N-(4-chlorophenyl)-5-methyl-N'-[[(2R)-2-oxolanyl]methyl]-2-isothiazol-2-iumcarboximidamide IUPAC Name: 3-amino-N-(4-chlorophenyl)-5-methyl-N'-[[(2R)-oxolan-2-yl]methyl]-1,2-thiazol-2-ium-2-carboximidamide Traditional Name: 3-amino-N-(4-chlorophenyl)-5-methyl-N'-[[(2R)-tetrahydrofuran-2-yl]methyl]isothiazol-2-ium-2-carboxamidine Formula: C16H20ClN4OS+ MolecularWeight: 351.8742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](S1)C(=NCC2CCCO2)NC3=CC=C(C=C3)Cl)N

Isomeric SMILES

CC1=CC(=[N+](S1)C(=NC[C@H]2CCCO2)NC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C16H19ClN4OS/c1-11-9-15(18)21(23-11)16(19-10-14-3-2-8-22-14)20-13-6-4-12(17)5-7-13/h4-7,9,14,18H,2-3,8,10H2,1H3,(H,19,20)/p+1/t14-/m1/s1