Vitas-M small molecule compound

N-carbamimidoyl-4-({(E)-2-cyano-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzenesulfonamide

Catalog ID
STK556901
SMILES CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)S(=O)(=O)NC(=N)N)/C#N

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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 C21H20N6O3S2 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3S2/c1-2-30-17-7-3-14(4-8-17)19-13-31-20(26-19)15(11-22)12-25-16-5-9-18(10-6-16)32(28,29)27-21(23)24/h3-10,12-13,25H,2H2,1H3,(H4,23,24,27)/b15-12+
InChIKey
ADLGYTLHWFJOLP-NTCAYCPXSA-N
Synonyms
573949-91-4
(E)Ncarbamimidoyl4((2cyano2(4(4ethoxyphenyl)thiazol2yl)vinyl)amino)benzenesulfonamide
2(4(((E)2CYANO2(4(4ETHOXYPHENYL)13THIAZOL2YL)ETHENYL)AMINO)PHENYL)SULFONYLGUANIDINE
573949914
CCOC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=C(C=C3)S(=O)(=O)N=C(N)N)C#N
CCOc1ccc(cc1)c1csc(n1)C(=CNc1ccc(cc1)S(=O)(=O)NC(=N)N)C#N
InChI=1SC21H20N6O3S2c1230177314(4817)19133120(2619)15(1122)1225165918(10616)32(2829)2721(23)24h310121325H2H21H3(H4232427)b1512+
MFCD04021323
Ncarbamimidoyl4(((E)2cyano2(4(4ethoxyphenyl)13thiazol2yl)ethenyl)amino)benzenesulfonamide
ZINC000002246084
ZINC02246084
ZINC2246084

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Available files

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