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

Systemtic Name: 3-azanyl-N-(4-chlorophenyl)-5-methyl-N'-phenethyl-1,2-thiazol-2-ium-2-carboximidamide Openeye Name: 3-amino-N-(4-chlorophenyl)-5-methyl-N'-phenethyl-isothiazol-2-ium-2-carboxamidine CAS Name: 3-amino-N-(4-chlorophenyl)-5-methyl-N'-phenethyl-2-isothiazol-2-iumcarboximidamide IUPAC Name: 3-amino-N-(4-chlorophenyl)-5-methyl-N'-phenethyl-1,2-thiazol-2-ium-2-carboximidamide Traditional Name: 3-amino-N-(4-chlorophenyl)-5-methyl-N'-phenethyl-isothiazol-2-ium-2-carboxamidine Formula: C19H20ClN4S+ MolecularWeight: 371.9069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](S1)C(=NCCC2=CC=CC=C2)NC3=CC=C(C=C3)Cl)N

Isomeric SMILES

CC1=CC(=[N+](S1)C(=NCCC2=CC=CC=C2)NC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C19H19ClN4S/c1-14-13-18(21)24(25-14)19(23-17-9-7-16(20)8-10-17)22-12-11-15-5-3-2-4-6-15/h2-10,13,21H,11-12H2,1H3,(H,22,23)/p+1