Benzoic acid, 4-[[[3-(acetylamino)-1-piperidinyl]carbonothioyl]amino]-, ethyl ester

SpectraBase Compound ID	BZnv2SocA15
InChI	InChI=1S/C17H23N3O3S/c1-3-23-16(22)13-6-8-14(9-7-13)19-17(24)20-10-4-5-15(11-20)18-12(2)21/h6-9,15H,3-5,10-11H2,1-2H3,(H,18,21)(H,19,24)
InChIKey	CKYAWWHNHAEREQ-UHFFFAOYSA-N Google Search
Mol Weight	349.45 g/mol
Molecular Formula	C17H23N3O3S
Exact Mass	349.146013 g/mol

Subscribe to view the full spectrum.

SpectraBase Spectrum ID	HoGHOXNlagE
Name	Benzoic acid, 4-[[[3-(acetylamino)-1-piperidinyl]carbonothioyl]amino]-, ethyl ester
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	349.146012784 u
Formula	C17H23N3O3S
InChI	InChI=1S/C17H23N3O3S/c1-3-23-16(22)13-6-8-14(9-7-13)19-17(24)20-10-4-5-15(11-20)18-12(2)21/h6-9,15H,3-5,10-11H2,1-2H3,(H,18,21)(H,19,24)
InChIKey	CKYAWWHNHAEREQ-UHFFFAOYSA-N
Molecular Weight	349.449 g/mol
SMILES	CC(NC1CN(CCC1)C(NC1=CC=C(C=C1)C(OCC)=O)=S)=O