N-[dibutoxyphosphoryl-[4-(trifluoromethyl)phenyl]methyl]-4-methyl-1,3-benzothiazol-2-amine

Systemtic Name: N-[dibutoxyphosphoryl-[4-(trifluoromethyl)phenyl]methyl]-4-methyl-1,3-benzothiazol-2-amine Openeye Name: N-[dibutoxyphosphoryl-[4-(trifluoromethyl)phenyl]methyl]-4-methyl-1,3-benzothiazol-2-amine CAS Name: N-[dibutoxyphosphoryl-[4-(trifluoromethyl)phenyl]methyl]-4-methyl-1,3-benzothiazol-2-amine IUPAC Name: N-[dibutoxyphosphoryl-[4-(trifluoromethyl)phenyl]methyl]-4-methyl-1,3-benzothiazol-2-amine Traditional Name: [dibutoxyphosphoryl-[4-(trifluoromethyl)phenyl]methyl]-(4-methyl-1,3-benzothiazol-2-yl)amine Formula: C24H30F3N2O3PS MolecularWeight: 514.540571

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(C(C1=CC=C(C=C1)C(F)(F)F)NC2=NC3=C(C=CC=C3S2)C)OCCCC

Isomeric SMILES

CCCCOP(=O)(C(C1=CC=C(C=C1)C(F)(F)F)NC2=NC3=C(C=CC=C3S2)C)OCCCC

InChI

InChI=1S/C24H30F3N2O3PS/c1-4-6-15-31-33(30,32-16-7-5-2)22(18-11-13-19(14-12-18)24(25,26)27)29-23-28-21-17(3)9-8-10-20(21)34-23/h8-14,22H,4-7,15-16H2,1-3H3,(H,28,29)