Vitas-M small molecule compound
N-(4-methoxyphenyl)-2-[(4-methyl-5-{3-[(4-methylphenyl)amino]-3-oxopropyl}-4H-1,2,4-triazol-3-yl)sulfanyl]propanamide
Catalog ID
STK297646
SMILES COc1ccc(cc1)NC(=O)C(Sc1nnc(n1C)CCC(=O)Nc1ccc(cc1)C)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 C23H27N5O3S MW 453.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O3S/c1-15-5-7-17(8-6-15)24-21(29)14-13-20-26-27-23(28(20)3)32-16(2)22(30)25-18-9-11-19(31-4)12-10-18/h5-12,16H,13-14H2,1-4H3,(H,24,29)(H,25,30)InChIKey
ZJHDGUVDBVWFMJ-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)NC(=O)CCC2=NN=C(N2C)SC(C)C(=O)NC3=CC=C(C=C3)OC
InChI=1SC23H27N5O3Sc1155717(8615)2421(29)141320262723(28(20)3)3216(2)22(30)251891119(314)121018h51216H1314H214H3(H2429)(H2530)
MFCD09192581
N(4methoxyphenyl)2((4methyl5(3((4methylphenyl)amino)3oxopropyl)4H124triazol3yl)sulfanyl)propanamide
N(4methoxyphenyl)2((4methyl5(3(4methylanilino)3oxopropyl)124triazol3yl)sulfanyl)propanamide
ZINC000010158327
ZINC000010158328
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