Vitas-M small molecule compound
2-({5-[(2-methoxyphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methoxyphenyl)ethanone
Catalog ID
STK186943
SMILES C=CCn1c(SCC(=O)c2ccc(cc2)OC)nnc1COc1ccccc1OC
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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 C22H23N3O4S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4S/c1-4-13-25-21(14-29-20-8-6-5-7-19(20)28-3)23-24-22(25)30-15-18(26)16-9-11-17(27-2)12-10-16/h4-12H,1,13-15H2,2-3H3InChIKey
XTEKSOOXQPIPPA-UHFFFAOYSA-NSynonyms
2((5((2METHOXYPHENOXY)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
2((5((2METHOXYPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
COC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2CC=C)COC3=CC=CC=C3OC
InChI=1SC22H23N3O4Sc14132521(142920865719(20)283)232422(25)301518(26)1691117(272)121016h412H11315H223H3
MFCD06006692
ZINC000001064226
ZINC01064226
ZINC1064226
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