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

Systemtic Name: 3-azanylidene-N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-chloranyl-4-fluoranyl-phenyl)-5-methyl-1,2-thiazole-2-carboximidamide Openeye Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-chloro-4-fluoro-phenyl)-3-imino-5-methyl-isothiazole-2-carboxamidine CAS Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-chloro-4-fluorophenyl)-3-imino-5-methyl-2-isothiazolecarboximidamide IUPAC Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-chloro-4-fluorophenyl)-3-imino-5-methyl-1,2-thiazole-2-carboximidamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-imino-5-methyl-N'-piperonyl-4-isothiazoline-2-carboxamidine Formula: C19H16ClFN4O2S MolecularWeight: 418.872343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=N)N(S1)C(=NCC2=CC3=C(C=C2)OCO3)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1=CC(=N)N(S1)C(=NCC2=CC3=C(C=C2)OCO3)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C19H16ClFN4O2S/c1-11-6-18(22)25(28-11)19(24-13-3-4-15(21)14(20)8-13)23-9-12-2-5-16-17(7-12)27-10-26-16/h2-8,22H,9-10H2,1H3,(H,23,24)