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

Systemtic Name: 3-azanyl-N'-[(4-chlorophenyl)methyl]-5-methyl-N-phenyl-1,2-thiazol-2-ium-2-carboximidamide Openeye Name: 3-amino-N'-[(4-chlorophenyl)methyl]-5-methyl-N-phenyl-isothiazol-2-ium-2-carboxamidine CAS Name: 3-amino-N'-[(4-chlorophenyl)methyl]-5-methyl-N-phenyl-2-isothiazol-2-iumcarboximidamide IUPAC Name: 3-amino-N'-[(4-chlorophenyl)methyl]-5-methyl-N-phenyl-1,2-thiazol-2-ium-2-carboximidamide Traditional Name: 3-amino-N'-(4-chlorobenzyl)-5-methyl-N-phenyl-isothiazol-2-ium-2-carboxamidine Formula: C18H18ClN4S+ MolecularWeight: 357.88032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](S1)C(=NCC2=CC=C(C=C2)Cl)NC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC(=[N+](S1)C(=NCC2=CC=C(C=C2)Cl)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H17ClN4S/c1-13-11-17(20)23(24-13)18(22-16-5-3-2-4-6-16)21-12-14-7-9-15(19)10-8-14/h2-11,20H,12H2,1H3,(H,21,22)/p+1