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

*Links on SpectraBase are not permalinks.
1-(3-Methylphenyl)-3-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)amino]thiourea
SpectraBase Compound ID BzYFSZowaHX
InChI InChI=1S/C18H17N7S/c1-11-6-5-7-12(10-11)19-18(26)24-23-17-20-16-15(21-22-17)13-8-3-4-9-14(13)25(16)2/h3-10H,1-2H3,(H2,19,24,26)(H,20,22,23)
InChIKey BFLJVWIGPQPBNO-UHFFFAOYSA-N
Mol Weight 363.44 g/mol
Molecular Formula C18H17N7S
Exact Mass 363.126615 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 2dnmZ9MteJN
Name 1-(3-Methylphenyl)-3-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)amino]thiourea
Alternate Name(s) 1-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)amino]-3-(m-tolyl)thiourea 1-[(5-methyl-[1,2,4]triazin[5,6-b]indol-3-yl)amino]-3-(m-tolyl)thiourea
CAS Registry Number 109880-00-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N7S
InChI InChI=1S/C18H17N7S/c1-11-6-5-7-12(10-11)19-18(26)24-23-17-20-16-15(21-22-17)13-8-3-4-9-14(13)25(16)2/h3-10H,1-2H3,(H2,19,24,26)(H,20,22,23)
InChIKey BFLJVWIGPQPBNO-UHFFFAOYSA-N
Molecular Weight 363.443 g/mol
SMILES N(c1nc2c(c3ccccc3[n]2C)nn1)NC(Nc1cc(C)ccc1)=S
SPLASH splash10-0a4i-1920000000-6af4402f341e95030929
Source of Spectrum Y-23-1734-14
Wiley ID 1350172