Vitas-M small molecule compound

2-(ethylsulfanyl)-6,6-dimethyl-9-(3-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one

Catalog ID
STK210430
SMILES CCSc1nn2c(n1)NC1=C(C2c2cccc(c2)[N+](=O)[O-])C(=O)CC(C1)(C)C

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H21N5O3S MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O3S/c1-4-28-18-21-17-20-13-9-19(2,3)10-14(25)15(13)16(23(17)22-18)11-6-5-7-12(8-11)24(26)27/h5-8,16H,4,9-10H2,1-3H3,(H,20,21,22)
InChIKey
PWPMHQQGAWUSTG-UHFFFAOYSA-N
Synonyms
727403-90-9
2(ethylsulfanyl)66dimethyl9(3nitrophenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2(ethylthio)66dimethyl9(3nitrophenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2ethylsulfanyl66dimethyl9(3nitrophenyl)1579tetrahydro(124)triazolo(51b)quinazolin8one
727403909
CCSC1=NC2=NC3=C(C(N2N1)C4=CC(=CC=C4)(N+)(=O)(O))C(=O)CC(C3)(C)C
CCSc1nn2c(n1)NC1=C(C2c2cccc(c2)(N+)(=O)(O))C(=O)CC(C1)(C)C
InChI=1SC19H21N5O3Sc14281821172013919(23)1014(25)15(13)16(23(17)2218)1165712(811)24(26)27h5816H4910H213H3(H202122)
MFCD06193268
ZINC000004777011
ZINC000004777012

Check stock

See real-time availability and sample size for STK210430 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.