3-azanylidene-N-(3-chloranyl-4-fluoranyl-phenyl)-5-methyl-N'-(3-morpholin-4-ylpropyl)-1,2-thiazole-2-carboximidamide

Systemtic Name: 3-azanylidene-N-(3-chloranyl-4-fluoranyl-phenyl)-5-methyl-N'-(3-morpholin-4-ylpropyl)-1,2-thiazole-2-carboximidamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-imino-5-methyl-N'-(3-morpholinopropyl)isothiazole-2-carboxamidine CAS Name: N-(3-chloro-4-fluorophenyl)-3-imino-5-methyl-N'-[3-(4-morpholinyl)propyl]-2-isothiazolecarboximidamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-imino-5-methyl-N'-(3-morpholin-4-ylpropyl)-1,2-thiazole-2-carboximidamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-imino-5-methyl-N'-(3-morpholinopropyl)-4-isothiazoline-2-carboxamidine Formula: C18H23ClFN5OS MolecularWeight: 411.924523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=N)N(S1)C(=NCCCN2CCOCC2)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=N)N(S1)C(=NCCCN2CCOCC2)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H23ClFN5OS/c1-13-11-17(21)25(27-13)18(23-14-3-4-16(20)15(19)12-14)22-5-2-6-24-7-9-26-10-8-24/h3-4,11-12,21H,2,5-10H2,1H3,(H,22,23)