S-(2-{6-[({4-[3-(Dimethylamino)Propoxy]Phenyl}Sulfonyl)Amino]-3-Pyridinyl}-2-Oxoethyl) Ethanethioate

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Formula C20H25N3O5S2
IUPAC Name s-[2-[6-[[4-[3-(dimethylamino)propoxy]phenyl]sulfonylamino]-3-pyridyl]-2-oxo-ethyl] ethanethioate
Molecular Mass 451.560 g·mol−1
Heat of Formation -670.3 ± 16.7 kJ·mol−1
Dipole Moment 7.34 ± 1.08 D
Volume 520.85 Å 3
Surface Area 373.05 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.06 ± eV
Point Group Symmetry C1
InChIKey KXWBUKMWZKTHCV-UHFFFAOYSA-N
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