2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-(5-chloranyl-2-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-(5-chloranyl-2-fluoranyl-phenyl)ethanamide Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-(5-chloro-2-fluoro-phenyl)acetamide CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-N-(5-chloro-2-fluorophenyl)acetamide IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-(5-chloro-2-fluorophenyl)acetamide Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-N-(5-chloro-2-fluoro-phenyl)acetamide Formula: C18H16ClFN6OS MolecularWeight: 418.875643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC(=O)NC3=C(C=CC(=C3)Cl)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC(=O)NC3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C18H16ClFN6OS/c19-11-6-7-13(20)14(8-11)23-16(27)10-28-9-15-24-17(21)26-18(25-15)22-12-4-2-1-3-5-12/h1-8H,9-10H2,(H,23,27)(H3,21,22,24,25,26)