N4-(3-chloranyl-4-methoxy-phenyl)-N2-cycloheptyl-6-(4-fluorophenyl)sulfanyl-1,3,5-triazine-2,4-diamine

Systemtic Name: N4-(3-chloranyl-4-methoxy-phenyl)-N2-cycloheptyl-6-(4-fluorophenyl)sulfanyl-1,3,5-triazine-2,4-diamine Openeye Name: N4-(3-chloro-4-methoxy-phenyl)-N2-cycloheptyl-6-(4-fluorophenyl)sulfanyl-1,3,5-triazine-2,4-diamine CAS Name: N4-(3-chloro-4-methoxyphenyl)-N2-cycloheptyl-6-[(4-fluorophenyl)thio]-1,3,5-triazine-2,4-diamine IUPAC Name: 4-N-(3-chloro-4-methoxyphenyl)-2-N-cycloheptyl-6-(4-fluorophenyl)sulfanyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-(3-chloro-4-methoxy-anilino)-6-[(4-fluorophenyl)thio]-s-triazin-2-yl]-cycloheptyl-amine Formula: C23H25ClFN5OS MolecularWeight: 473.993903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)SC3=CC=C(C=C3)F)NC4CCCCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)SC3=CC=C(C=C3)F)NC4CCCCCC4)Cl

InChI

InChI=1S/C23H25ClFN5OS/c1-31-20-13-10-17(14-19(20)24)27-22-28-21(26-16-6-4-2-3-5-7-16)29-23(30-22)32-18-11-8-15(25)9-12-18/h8-14,16H,2-7H2,1H3,(H2,26,27,28,29,30)