Vitas-M small molecule compound

4-chloro-N-[5-(3-hydroxypropyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl]benzenesulfonamide

Catalog ID
STK871504
SMILES OCCCN1CNC(=NC1)NS(=O)(=O)c1ccc(cc1)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 C12H17ClN4O3S MW 332.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17ClN4O3S/c13-10-2-4-11(5-3-10)21(19,20)16-12-14-8-17(9-15-12)6-1-7-18/h2-5,18H,1,6-9H2,(H2,14,15,16)
InChIKey
NBNCTXKKRWLBLI-UHFFFAOYSA-N
Synonyms
1158592-56-3
1158592563
4chloroN(3(3hydroxypropyl)24dihydro1H135triazin6yl)benzenesulfonamide
4chloroN(5(3hydroxypropyl)1456tetrahydro135triazin2yl)benzenesulfonamide
C1NC(=NCN1CCCO)NS(=O)(=O)C2=CC=C(C=C2)Cl
InChI=1SC12H17ClN4O3Sc13102411(5310)21(1920)161214817(91512)61718h2518H169H2(H2141516)
MFCD13760662
ZINC000030874872
ZINC30874872

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Available files

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