Vitas-M small molecule compound
N-[4-(5-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)phenyl]-2-methylbenzamide
Catalog ID
STL357641
SMILES O=C(CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccccc1C)NCc1ccccc1
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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 C26H25N5O2S MW 471.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O2S/c1-18-8-6-7-11-22(18)25(33)28-21-14-12-20(13-15-21)24-29-30-26(31(24)2)34-17-23(32)27-16-19-9-4-3-5-10-19/h3-15H,16-17H2,1-2H3,(H,27,32)(H,28,33)InChIKey
VCJMVKKGAADSCN-UHFFFAOYSA-NSynonyms
443666-70-4443666704
CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C3=NN=C(N3C)SCC(=O)NCC4=CC=CC=C4
InChI=1SC26H25N5O2Sc1188671122(18)25(33)2821141220(131521)24293026(31(24)2)341723(32)27161994351019h315H1617H212H3(H2732)(H2833)
MFCD02953935
N(4(5((2(benzylamino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)phenyl)2methylbenzamide
N(4(5((2(benzylamino)2oxoethyl)thio)4methyl4H124triazol3yl)phenyl)2methylbenzamide
N(4(5(2(BENZYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)PHENYL)2METHYLBENZAMIDE
ZINC000002354127
ZINC02354127
ZINC2354127
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