Vitas-M small molecule compound

4-{[(4-bromophenyl)sulfonyl](methyl)amino}-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-phenylbutanamide

Catalog ID
STK683026
SMILES CCc1nnc(s1)NC(=O)CC(c1ccccc1)CN(S(=O)(=O)c1ccc(cc1)Br)C

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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 C21H23BrN4O3S2 MW 523.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN4O3S2/c1-3-20-24-25-21(30-20)23-19(27)13-16(15-7-5-4-6-8-15)14-26(2)31(28,29)18-11-9-17(22)10-12-18/h4-12,16H,3,13-14H2,1-2H3,(H,23,25,27)
InChIKey
KRHWSFWQSHYISI-UHFFFAOYSA-N
Synonyms

4(((4bromophenyl)sulfonyl)(methyl)amino)N(5ethyl134thiadiazol2yl)3phenylbutanamide
4((4BROMOPHENYL)SULFONYLMETHYLAMINO)N(5ETHYL134THIADIAZOL2YL)3PHENYLBUTANAMIDE
CCC1=NN=C(S1)NC(=O)CC(CN(C)S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3
InChI=1SC21H23BrN4O3S2c1320242521(3020)2319(27)1316(157546815)1426(2)31(2829)1811917(22)101218h41216H31314H212H3(H232527)
MFCD04061835
ZINC000098005939
ZINC000098005940

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Available files

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