For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-(4-Methylpiperidin-1-yl)carbonyl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide
SpectraBase Compound ID 5CWdts3YEtO
InChI InChI=1S/C21H21N3O2S2/c1-13-8-10-24(11-9-13)20(26)16-5-3-2-4-15(16)19(25)22-14-6-7-17-18(12-14)28-21(27)23-17/h2-7,12-13H,8-11H2,1H3,(H,22,25)(H,23,27)
InChIKey PHMXTFAKKWFGSX-UHFFFAOYSA-N
Mol Weight 411.54 g/mol
Molecular Formula C21H21N3O2S2
Exact Mass 411.107519 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I6NeYwCwkj3
Name 2-(4-Methylpiperidin-1-yl)carbonyl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21N3O2S2
InChI InChI=1S/C21H21N3O2S2/c1-13-8-10-24(11-9-13)20(26)16-5-3-2-4-15(16)19(25)22-14-6-7-17-18(12-14)28-21(27)23-17/h2-7,12-13H,8-11H2,1H3,(H,22,25)(H,23,27)
InChIKey PHMXTFAKKWFGSX-UHFFFAOYSA-N
Molecular Weight 411.538 g/mol
SMILES N(C(c1c(C(N2CCC(CC2)C)=O)cccc1)=O)c1ccc2NC(Sc2c1)=S
SPLASH splash10-0006-9000000000-71eb94403394bf512b6e
Synonyms 2-(4-Methylpiperidine-1-carbonyl)-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide 2-(4-Methylpiperidine-1-carbonyl)-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)benzamide 2-[(4-methyl-1-piperidinyl)-oxomethyl]-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide
Wiley ID 1455156