N-[diphenoxyphosphoryl(phenyl)methyl]-5-methyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-[diphenoxyphosphoryl(phenyl)methyl]-5-methyl-1,3,4-thiadiazol-2-amine Openeye Name: N-[diphenoxyphosphoryl(phenyl)methyl]-5-methyl-1,3,4-thiadiazol-2-amine CAS Name: N-[diphenoxyphosphoryl(phenyl)methyl]-5-methyl-1,3,4-thiadiazol-2-amine IUPAC Name: N-[diphenoxyphosphoryl(phenyl)methyl]-5-methyl-1,3,4-thiadiazol-2-amine Traditional Name: [diphenoxyphosphoryl(phenyl)methyl]-(5-methyl-1,3,4-thiadiazol-2-yl)amine Formula: C22H20N3O3PS MolecularWeight: 437.451261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(C2=CC=CC=C2)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(S1)NC(C2=CC=CC=C2)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H20N3O3PS/c1-17-24-25-22(30-17)23-21(18-11-5-2-6-12-18)29(26,27-19-13-7-3-8-14-19)28-20-15-9-4-10-16-20/h2-16,21H,1H3,(H,23,25)