Vitas-M small molecule compound

N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-chloro-2-(ethylsulfanyl)pyrimidine-4-carboxamide

Catalog ID
STK882592
SMILES CCSc1ncc(c(n1)C(=O)Nc1nnc(s1)SCc1ccccc1)Cl

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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 C16H14ClN5OS3 MW 423.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN5OS3/c1-2-24-14-18-8-11(17)12(19-14)13(23)20-15-21-22-16(26-15)25-9-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,20,21,23)
InChIKey
ZJUXFQWDMODDJL-UHFFFAOYSA-N
Synonyms

CCSC1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)Cl
InChI=1SC16H14ClN5OS3c12241418811(17)12(1914)13(23)2015212216(2615)259106435710h38H29H21H3(H202123)
MFCD06646292
N(5(benzylsulfanyl)134thiadiazol2yl)5chloro2(ethylsulfanyl)pyrimidine4carboxamide
N(5benzylsulfanyl134thiadiazol2yl)5chloro2ethylsulfanylpyrimidine4carboxamide
ZINC000009431777
ZINC09431777
ZINC9431777

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Available files

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