Vitas-M small molecule compound
N-[5-(3-chloro-4-methylbenzyl)-1,3-thiazol-2-yl]-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL017315
SMILES C=CCn1c(SCC(=O)Nc2ncc(s2)Cc2ccc(c(c2)Cl)C)nnc1c1ccncc1
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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 C23H21ClN6OS2 MW 497.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN6OS2/c1-3-10-30-21(17-6-8-25-9-7-17)28-29-23(30)32-14-20(31)27-22-26-13-18(33-22)11-16-5-4-15(2)19(24)12-16/h3-9,12-13H,1,10-11,14H2,2H3,(H,26,27,31)InChIKey
IWTQSVBRTRGSFX-UHFFFAOYSA-NSynonyms
2((4ALLYL5(4PYRIDINYL)4H124TRIAZOL3YL)THIO)N(5(3CHLORO4METHYLBENZYL)13THIAZOL2YL)ACETAMIDE
CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)CSC3=NN=C(N3CC=C)C4=CC=NC=C4)Cl
InChI=1SC23H21ClN6OS2c13103021(1768259717)282923(30)321420(31)2722261318(3322)11165415(2)19(24)1216h391213H1101114H22H3(H262731)
MFCD03819654
N(5((3CHLORO4METHYLPHENYL)METHYL)(13THIAZOL2YL))2(4PROP2ENYL5(4PYRIDYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(5((3chloro4methylphenyl)methyl)13thiazol2yl)2((4prop2enyl5pyridin4yl124triazol3yl)sulfanyl)acetamide
N(5(3chloro4methylbenzyl)13thiazol2yl)2((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)acetamide
ZINC000000949871
ZINC00949871
ZINC949871
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