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benzamide, 4-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-
SpectraBase Compound ID 5Rcr1NJMyv9
InChI InChI=1S/C16H19N5O4S2/c1-11-18-19-16(26-11)17-15(23)13-3-5-14(6-4-13)27(24,25)21-9-7-20(8-10-21)12(2)22/h3-6H,7-10H2,1-2H3,(H,17,19,23)
InChIKey ZVQVXMSPTOCLGE-UHFFFAOYSA-N
Mol Weight 409.48 g/mol
Molecular Formula C16H19N5O4S2
Exact Mass 409.087846 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hw5PPl5mp8D
Name Benzamide, 4-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.087846456 u
Formula C16H19N5O4S2
InChI InChI=1S/C16H19N5O4S2/c1-11-18-19-16(26-11)17-15(23)13-3-5-14(6-4-13)27(24,25)21-9-7-20(8-10-21)12(2)22/h3-6H,7-10H2,1-2H3,(H,17,19,23)
InChIKey ZVQVXMSPTOCLGE-UHFFFAOYSA-N
Molecular Weight 409.479 g/mol
SMILES N(C=1SC(C)=NN1)C(C1=CC=C(S(N2CCN(CC2)C(=O)C)(=O)=O)C=C1)=O