N-{3-(2-Oxo-2,3-Dihydro-1,3-Thiazol-4-Yl)-5-[(2-Thienylsulfonyl)Amino]Phenyl}Butanamide

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Properties Simple | Detailed

Formula C17H17N3O4S3
IUPAC Name n-[3-(2-oxothiazole-1,3-diium-4-yl)-5-(2-thienylsulfonylamino)phenyl]butanamide
Molecular Mass 423.530 g·mol−1
Heat of Formation -423.1 ± 16.7 kJ·mol−1
Dipole Moment 5.23 ± 1.08 D
Volume 455.55 Å 3
Surface Area 399.35 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy 1.76 ± eV
Point Group Symmetry C1
InChIKey KWWYOIOTRAVAHK-UHFFFAOYSA-N
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