Vitas-M small molecule compound

N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(2,2-dimethylpropanoyl)piperidine-4-carboxamide

Catalog ID
STK348428
SMILES O=C(C1CCN(CC1)C(=O)C(C)(C)C)Nc1nnc(s1)CSCc1ccccc1

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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 C21H28N4O2S2 MW 432.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O2S2/c1-21(2,3)19(27)25-11-9-16(10-12-25)18(26)22-20-24-23-17(29-20)14-28-13-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3,(H,22,24,26)
InChIKey
HSWDUPSFFSKQNN-UHFFFAOYSA-N
Synonyms

CC(C)(C)C(=O)N1CCC(CC1)C(=O)NC2=NN=C(S2)CSCC3=CC=CC=C3
InChI=1SC21H28N4O2S2c121(23)19(27)2511916(101225)18(26)2220242317(2920)142813157546815h4816H914H213H3(H222426)
MFCD09458480
N(5((benzylsulfanyl)methyl)134thiadiazol2yl)1(22dimethylpropanoyl)piperidine4carboxamide
N(5(benzylsulfanylmethyl)134thiadiazol2yl)1(22dimethylpropanoyl)piperidine4carboxamide
ZINC000012865233
ZINC12865233

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Available files

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