Vitas-M small molecule compound

N-(3-chloro-4-fluorophenyl)-2-{[5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK136283
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nnc1c1ccc(cc1)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 C20H18ClFN4OS MW 416.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClFN4OS/c1-3-10-26-19(14-6-4-13(2)5-7-14)24-25-20(26)28-12-18(27)23-15-8-9-17(22)16(21)11-15/h3-9,11H,1,10,12H2,2H3,(H,23,27)
InChIKey
DKVDUZYNQAMNJS-UHFFFAOYSA-N
Synonyms
701286-55-7
2((4allyl5(ptolyl)4H124triazol3yl)thio)N(3chloro4fluorophenyl)acetamide
701286557
CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC(=C(C=C3)F)Cl
InChI=1SC20H18ClFN4OSc13102619(146413(2)5714)242520(26)281218(27)23158917(22)16(21)1115h3911H11012H22H3(H2327)
MFCD04394828
N(3CHLORO4FLUOROPHENYL)2((5(4METHYLPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3CHLORO4FLUOROPHENYL)2((5(4METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001117933
ZINC01117933
ZINC1117933

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Available files

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