Vitas-M small molecule compound

N-{2-[5-({1-[(3-acetylphenyl)amino]-1-oxobutan-2-yl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-2-fluorobenzamide

Catalog ID
STK246113
SMILES CCC(C(=O)Nc1cccc(c1)C(=O)C)Sc1nnc(n1C)CCNC(=O)c1ccccc1F

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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 C24H26FN5O3S MW 483.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26FN5O3S/c1-4-20(23(33)27-17-9-7-8-16(14-17)15(2)31)34-24-29-28-21(30(24)3)12-13-26-22(32)18-10-5-6-11-19(18)25/h5-11,14,20H,4,12-13H2,1-3H3,(H,26,32)(H,27,33)
InChIKey
NTCZDQDFUKERSD-UHFFFAOYSA-N
Synonyms

CCC(C(=O)NC1=CC=CC(=C1)C(=O)C)SC2=NN=C(N2C)CCNC(=O)C3=CC=CC=C3F
InChI=1SC24H26FN5O3Sc1420(23(33)271797816(1417)15(2)31)3424292821(30(24)3)12132622(32)1810561119(18)25h5111420H41213H213H3(H2632)(H2733)
MFCD08683294
N(2(5((1((3acetylphenyl)amino)1oxobutan2yl)sulfanyl)4methyl4H124triazol3yl)ethyl)2fluorobenzamide
N(2(5(1(3acetylanilino)1oxobutan2yl)sulfanyl4methyl124triazol3yl)ethyl)2fluorobenzamide
N(2(5(1(3ACETYLPHENYLCARBAMOYL)PROPYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
ZINC000009328827
ZINC000009328830

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Available files

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