Vitas-M small molecule compound
2-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethanone
Catalog ID
STK152840
SMILES COc1ccc(cc1)c1nnc([nH]1)SCC(=O)N1CCN(CC1)c1ccccc1
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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 C21H23N5O2S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2S/c1-28-18-9-7-16(8-10-18)20-22-21(24-23-20)29-15-19(27)26-13-11-25(12-14-26)17-5-3-2-4-6-17/h2-10H,11-15H2,1H3,(H,22,23,24)InChIKey
ZUYCCYVAPPVOCF-UHFFFAOYSA-NSynonyms
2((5(4METHOXYPHENYL)1H124TRIAZOL3YL)SULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
2((5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
COC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)N3CCN(CC3)C4=CC=CC=C4
COc1ccc(cc1)c1nnc((nH)1)SCC(=O)N1CCN(CC1)c1ccccc1
InChI=1SC21H23N5O2Sc128189716(81018)202221(242320)291519(27)26131125(121426)175324617h210H1115H21H3(H222324)
MFCD05992831
ZINC000018254782
ZINC18254782
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