Vitas-M small molecule compound
2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-methyl-6-(propan-2-yl)phenyl]acetamide
Catalog ID
STK585982
SMILES O=C(Nc1c(C)cccc1C(C)C)CSc1nnc(n1N)c1[nH]nc2c1CCC2
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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 C20H25N7OS MW 411.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N7OS/c1-11(2)13-7-4-6-12(3)17(13)22-16(28)10-29-20-26-25-19(27(20)21)18-14-8-5-9-15(14)23-24-18/h4,6-7,11H,5,8-10,21H2,1-3H3,(H,22,28)(H,23,24)InChIKey
RIXKTZNOCISMOA-UHFFFAOYSA-NSynonyms
900895-10-52((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)124triazol3yl)sulfanyl)N(2methyl6propan2ylphenyl)acetamide
2((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol3yl)thio)N(2isopropyl6methylphenyl)acetamide
2((4amino5(2456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol3yl)sulfanyl)N(2methyl6(propan2yl)phenyl)acetamide
2(4AMINO5(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)(124TRIAZOL3YLTHIO))N(6METHYL2(METHYLETHYL)PHENYL)ACETAMIDE
900895105
CC1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=NN=C(N2N)C3=NNC4=C3CCC4
InChI=1SC20H25N7OSc111(2)1374612(3)17(13)2216(28)102920262519(27(20)21)181485915(14)232418h46711H581021H213H3(H2228)(H2324)
MFCD07211789
O=C(Nc1c(C)cccc1C(C)C)CSc1nnc(n1N)c1(nH)nc2c1CCC2
O=C(Nc1c(C)cccc1C(C)C)CSc1nnc(n1N)c1n(nH)c2c1CCC2
ZINC000009324680
ZINC09324680
ZINC9324680
Check stock
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Check stock on Vitas-MAvailable files
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