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4-Benzoyl-5,5-dimethyl-2-(3-phenyl-ureido)-4,5-dihydro-1,3,4-thiadiazol
SpectraBase Compound ID 4YoRsFp21CY
InChI InChI=1S/C18H18N4O2S/c1-18(2)22(15(23)13-9-5-3-6-10-13)21-17(25-18)20-16(24)19-14-11-7-4-8-12-14/h3-12H,1-2H3,(H2,19,20,21,24)
InChIKey BHTBZBZXDWTPEV-UHFFFAOYSA-N
Mol Weight 354.43 g/mol
Molecular Formula C18H18N4O2S
Exact Mass 354.115047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9icB3Tv09YM
Name 4-Benzoyl-5,5-dimethyl-2-(3-phenyl-ureido)-4,5-dihydro-1,3,4-thiadiazol
CAS Registry Number 106467-60-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H18N4O2S
InChI InChI=1S/C18H18N4O2S/c1-18(2)22(15(23)13-9-5-3-6-10-13)21-17(25-18)20-16(24)19-14-11-7-4-8-12-14/h3-12H,1-2H3,(H2,19,20,21,24)
InChIKey BHTBZBZXDWTPEV-UHFFFAOYSA-N
Literature Reference H. Graubaum, K. Nadolski, S. Andreae, Z. Chem. 26, 99 (1986).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6