N-[dipropoxyphosphoryl-(2-fluorophenyl)methyl]-4-methyl-1,3-benzothiazol-2-amine

Systemtic Name: N-[dipropoxyphosphoryl-(2-fluorophenyl)methyl]-4-methyl-1,3-benzothiazol-2-amine Openeye Name: N-[dipropoxyphosphoryl-(2-fluorophenyl)methyl]-4-methyl-1,3-benzothiazol-2-amine CAS Name: N-[dipropoxyphosphoryl-(2-fluorophenyl)methyl]-4-methyl-1,3-benzothiazol-2-amine IUPAC Name: N-[dipropoxyphosphoryl-(2-fluorophenyl)methyl]-4-methyl-1,3-benzothiazol-2-amine Traditional Name: [dipropoxyphosphoryl-(2-fluorophenyl)methyl]-(4-methyl-1,3-benzothiazol-2-yl)amine Formula: C21H26FN2O3PS MolecularWeight: 436.479904

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Descriptors Computed from Structure

Canonical SMILES:

CCCOP(=O)(C(C1=CC=CC=C1F)NC2=NC3=C(C=CC=C3S2)C)OCCC

Isomeric SMILES

CCCOP(=O)(C(C1=CC=CC=C1F)NC2=NC3=C(C=CC=C3S2)C)OCCC

InChI

InChI=1S/C21H26FN2O3PS/c1-4-13-26-28(25,27-14-5-2)20(16-10-6-7-11-17(16)22)24-21-23-19-15(3)9-8-12-18(19)29-21/h6-12,20H,4-5,13-14H2,1-3H3,(H,23,24)