Geometry & MOs

Info

ID:	17295
PubChem CID:	491974
Reduced:	S2O4N5C18H25 (1)
Stoich.:	A2B4C5D18E25 (1)
Weight, g/mol:	439.134797
ΔH_f, kcal/mol:	-107.85
Dipole, Da:	3.79
IP(EA), eV:	-8.27(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(dimethylsulfamoyl)-4-methyl-1,3-thiazol-2-yl]-1-methyl-3-(4-morpholin-4-ylphenyl)urea

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)N(C)C(=O)NC2=CC=C(C=C2)N3CCOCC3)S(=O)(=O)N(C)C

DOS

IR

Vibrations