Vitas-M small molecule compound
2-{[5-(1H-benzotriazol-1-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
Catalog ID
STL191408
SMILES O=C(Nc1cc(C)ccc1C)CSc1nnc(n1c1ccccc1)Cn1nnc2c1cccc2
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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 C25H23N7OS MW 469.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N7OS/c1-17-12-13-18(2)21(14-17)26-24(33)16-34-25-29-28-23(32(25)19-8-4-3-5-9-19)15-31-22-11-7-6-10-20(22)27-30-31/h3-14H,15-16H2,1-2H3,(H,26,33)InChIKey
WHCXAUKKKRQJBJ-UHFFFAOYSA-NSynonyms
2((5(1Hbenzotriazol1ylmethyl)4phenyl4H124triazol3yl)sulfanyl)N(25dimethylphenyl)acetamide
2((5(benzotriazol1ylmethyl)4phenyl124triazol3yl)sulfanyl)N(25dimethylphenyl)acetamide
CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CN4C5=CC=CC=C5N=N4
InChI=1SC25H23N7OSc117121318(2)21(1417)2624(33)163425292823(32(25)198435919)15312211761020(22)273031h314H1516H212H3(H2633)
MFCD20261555
ZINC000022409618
ZINC22409618
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