Vitas-M small molecule compound

4-methoxy-N-{[5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide

Catalog ID
STK497530
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1CC=C)SCC(=O)N1CCOCC1

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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 C20H25N5O4S MW 431.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O4S/c1-3-8-25-17(13-21-19(27)15-4-6-16(28-2)7-5-15)22-23-20(25)30-14-18(26)24-9-11-29-12-10-24/h3-7H,1,8-14H2,2H3,(H,21,27)
InChIKey
JHVUUBSFPPVHQL-UHFFFAOYSA-N
Synonyms

4methoxyN((5((2(morpholin4yl)2oxoethyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)methyl)benzamide
4methoxyN((5(2morpholin4yl2oxoethyl)sulfanyl4prop2enyl124triazol3yl)methyl)benzamide
COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CC=C)SCC(=O)N3CCOCC3
InChI=1SC20H25N5O4Sc1382517(132119(27)154616(282)7515)222320(25)301418(26)2491129121024h37H1814H22H3(H2127)
MFCD11854918
ZINC000032579259
ZINC32579259

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Available files

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