Vitas-M small molecule compound

2-{[5-(4-chloro-1,5-dimethyl-1H-pyrazol-3-yl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethoxyphenyl)acetamide

Catalog ID
STK956299
SMILES COc1ccc(cc1OC)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1nn(c(c1Cl)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 C24H25ClN6O3S MW 513.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN6O3S/c1-14-6-9-17(10-7-14)31-23(22-21(25)15(2)30(3)29-22)27-28-24(31)35-13-20(32)26-16-8-11-18(33-4)19(12-16)34-5/h6-12H,13H2,1-5H3,(H,26,32)
InChIKey
LTLLIHKHDCQIPK-UHFFFAOYSA-N
Synonyms
512812-49-6
2((5(4chloro15dimethyl1Hpyrazol3yl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(34dimethoxyphenyl)acetamide
2((5(4CHLORO15DIMETHYLPYRAZOL3YL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(34DIMETHOXYPHENYL)ACETAMIDE
512812496
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=C(C=C3)OC)OC)C4=NN(C(=C4Cl)C)C
InChI=1SC24H25ClN6O3Sc1146917(10714)3123(2221(25)15(2)30(3)2922)272824(31)351320(32)261681118(334)19(1216)345h612H13H215H3(H2632)
MFCD03075077
ZINC000000651229
ZINC00651229
ZINC651229

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Available files

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