Vitas-M small molecule compound
2-(4-methoxyphenyl)-N-{1-[5-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}acetamide
Catalog ID
STK186655
SMILES C=CCn1c(SCC(=O)Nc2ccccc2C)nnc1C(NC(=O)Cc1ccc(cc1)OC)C
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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 C25H29N5O3S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O3S/c1-5-14-30-24(18(3)26-22(31)15-19-10-12-20(33-4)13-11-19)28-29-25(30)34-16-23(32)27-21-9-7-6-8-17(21)2/h5-13,18H,1,14-16H2,2-4H3,(H,26,31)(H,27,32)InChIKey
HTGCHEZFXGUHOJ-UHFFFAOYSA-NSynonyms
2(4METHOXYPHENYL)N(1(5((2((2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)ETHYL)ACETAMIDE
2(4METHOXYPHENYL)N(1(5(2(2METHYLANILINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)ETHYL)ACETAMIDE
CC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC=C)C(C)NC(=O)CC3=CC=C(C=C3)OC
InChI=1SC25H29N5O3Sc15143024(18(3)2622(31)1519101220(334)131119)282925(30)341623(32)2721976817(21)2h51318H11416H224H3(H2631)(H2732)
MFCD05998868
ZINC000009261756
ZINC000009261759
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