Vitas-M small molecule compound

Catalog ID
STK920482
SMILES COCCn1c[nH]c2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1cccs1

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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 C20H17N6O2S MW 405.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N6O2S/c1-28-9-8-25-12-21-18-16(20(25)27)17-19(24-15-7-3-2-6-14(15)23-17)26(18)22-11-13-5-4-10-29-13/h2-7,10-12H,8-9H2,1H3,(H,21,27)/b22-11+
InChIKey
ZIHHNKWJWKCBIB-SSDVNMTOSA-N
Synonyms

COCCn1c(nH)c2c(c1=O)c1nc3ccccc3nc1n2N=Cc1cccs1
MFCD18175805

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Available files

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