Molecule ID: 50367

IUPAC Name: 2-tert-butylimino-5-phenyl-3-propan-2-yl-1,3,5-thiadiazinan-4-one

Description: The molecule is a 2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one in which the C=N double bond has Z configuration. It has a role as an insecticide and a member of homopteran inhibitor of chitin biosynthesis.

SMILES: CC(C)N1C(=O)N(c2ccccc2)CSC1=NC(C)(C)C

SELFIES: [C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][S][C][Ring1][=N][=N][C][Branch1][C][C][Branch1][C][C][C]

InChI: InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3

Molecular Properties:
- Polar Surface Area: 61.2 Ų
- LogP: 3.8