Vitas-M small molecule compound

2-{[4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide

Catalog ID
STL144856
SMILES O=C(Nc1cccc2c1cccc2)CSc1nnc(n1N)c1n[nH]c2c1CCC2

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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 C20H19N7OS MW 405.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N7OS/c21-27-19(18-14-8-4-10-16(14)23-24-18)25-26-20(27)29-11-17(28)22-15-9-3-6-12-5-1-2-7-13(12)15/h1-3,5-7,9H,4,8,10-11,21H2,(H,22,28)(H,23,24)
InChIKey
DNGYPRZKSSPUNQ-UHFFFAOYSA-N
Synonyms
900270-63-5
2((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)124triazol3yl)sulfanyl)Nnaphthalen1ylacetamide
2((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol3yl)sulfanyl)N(naphthalen1yl)acetamide
2((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol3yl)thio)N(naphthalen1yl)acetamide
2(4AMINO5(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)(124TRIAZOL3YLTHIO))NNAPHTHYLACETAMIDE
900270635
C1CC2=C(C1)NN=C2C3=NN=C(N3N)SCC(=O)NC4=CC=CC5=CC=CC=C54
InChI=1SC20H19N7OSc212719(1814841016(14)232418)252620(27)291117(28)221593612512713(12)15h13579H48101121H2(H2228)(H2324)
MFCD06772429
O=C(Nc1cccc2c1cccc2)CSc1nnc(n1N)c1n(nH)c2c1CCC2
ZINC000009110167
ZINC09110167
ZINC9110167

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Available files

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