Vitas-M small molecule compound

N-(2-{[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]amino}-2-oxoethyl)-4-(pyridin-2-yl)piperazine-1-carboxamide

Catalog ID
STL162074
SMILES O=C(/N=c\1/[nH]nc(s1)C1CCCCC1)CNC(=O)N1CCN(CC1)c1ccccn1

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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 C20H27N7O2S MW 429.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N7O2S/c28-17(23-19-25-24-18(30-19)15-6-2-1-3-7-15)14-22-20(29)27-12-10-26(11-13-27)16-8-4-5-9-21-16/h4-5,8-9,15H,1-3,6-7,10-14H2,(H,22,29)(H,23,25,28)
InChIKey
LTHJVHKEAVYLLH-UHFFFAOYSA-N
Synonyms
1246057-68-0
1246057680
C1CCC(CC1)C2=NN=C(S2)NC(=O)CNC(=O)N3CCN(CC3)C4=CC=CC=N4
InChI=1SC20H27N7O2Sc2817(2319252418(3019)156213715)142220(29)27121026(111327)1684592116h458915H13671014H2(H2229)(H232528)
MFCD20759568
N(2(((2Z)5cyclohexyl134thiadiazol2(3H)ylidene)amino)2oxoethyl)4(pyridin2yl)piperazine1carboxamide
N(2((5cyclohexyl134thiadiazol2yl)amino)2oxoethyl)4pyridin2ylpiperazine1carboxamide
O=C(N=c1(nH)nc(s1)C1CCCCC1)CNC(=O)N1CCN(CC1)c1ccccn1
ZINC000049548160
ZINC49548160

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Available files

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