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5-[(anilinocarbonyl)amino]-2,2-dimethyl-N-phenyl-1,3,4-thiadiazole-3(2H)-carboxamide

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5-[(anilinocarbonyl)amino]-2,2-dimethyl-N-phenyl-1,3,4-thiadiazole-3(2H)-carboxamide
SpectraBase Compound ID FQF69hszjJ2
InChI InChI=1S/C18H19N5O2S/c1-18(2)23(17(25)20-14-11-7-4-8-12-14)22-16(26-18)21-15(24)19-13-9-5-3-6-10-13/h3-12H,1-2H3,(H,20,25)(H2,19,21,22,24)
InChIKey CYSRWWFFGLKKTI-UHFFFAOYSA-N
Mol Weight 369.44 g/mol
Molecular Formula C18H19N5O2S
Exact Mass 369.125946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3s0fcDYGVdG
Name 4-Anilinocarbonyl-5,5-dimethyl-2-(3-phenyl-ureido)-4,5-dihydro-1,3,4-thiadiazol
CAS Registry Number 106467-54-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H19N5O2S
InChI InChI=1S/C18H19N5O2S/c1-18(2)23(17(25)20-14-11-7-4-8-12-14)22-16(26-18)21-15(24)19-13-9-5-3-6-10-13/h3-12H,1-2H3,(H,20,25)(H2,19,21,22,24)
InChIKey CYSRWWFFGLKKTI-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