Vitas-M small molecule compound

(2Z)-2-[1-(4-{[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}phenyl)ethylidene]hydrazinecarbothioamide

Catalog ID
STK376468
SMILES C/C(=N/NC(=S)N)/c1ccc(cc1)Nc1nc(nc(n1)N1CCOCC1)N1CCOCC1

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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 C20H27N9O2S MW 457.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N9O2S/c1-14(26-27-17(21)32)15-2-4-16(5-3-15)22-18-23-19(28-6-10-30-11-7-28)25-20(24-18)29-8-12-31-13-9-29/h2-5H,6-13H2,1H3,(H3,21,27,32)(H,22,23,24,25)/b26-14-
InChIKey
SJRJXKOCFMVACP-WGARJPEWSA-N
Synonyms

((Z)1(4((46DIMORPHOLIN4YL135TRIAZIN2YL)AMINO)PHENYL)ETHYLIDENEAMINO)THIOUREA
(2Z)2(1(4((46di(morpholin4yl)135triazin2yl)amino)phenyl)ethylidene)hydrazinecarbothioamide
CC(=NNC(=S)N)C1=CC=C(C=C1)NC2=NC(=NC(=N2)N3CCOCC3)N4CCOCC4
CC(=NNC(=S)N)c1ccc(cc1)Nc1nc(nc(n1)N1CCOCC1)N1CCOCC1
InChI=1SC20H27N9O2Sc114(262717(21)32)152416(5315)22182319(286103011728)2520(2418)298123113929h25H613H21H3(H3212732)(H22232425)b2614
MFCD00657386
ZINC000004046038
ZINC13881978

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Available files

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