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-(4-methylphenyl)acetamide

Catalog ID
STK596597
SMILES O=C(Nc1ccc(cc1)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 C17H19N7OS MW 369.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N7OS/c1-10-5-7-11(8-6-10)19-14(25)9-26-17-23-22-16(24(17)18)15-12-3-2-4-13(12)20-21-15/h5-8H,2-4,9,18H2,1H3,(H,19,25)(H,20,21)
InChIKey
XZNCBLDSBWIYGB-UHFFFAOYSA-N
Synonyms
900884-81-3
2((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)124triazol3yl)sulfanyl)N(4methylphenyl)acetamide
2((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol3yl)thio)N(ptolyl)acetamide
2((4amino5(2456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol3yl)sulfanyl)N(4methylphenyl)acetamide
2(4AMINO5(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)(124TRIAZOL3YLTHIO))N(4METHYLPHENYL)ACETAMIDE
900884813
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=NNC4=C3CCC4
InChI=1SC17H19N7OSc1105711(8610)1914(25)92617232216(24(17)18)151232413(12)202115h58H24918H21H3(H1925)(H2021)
MFCD07204987
O=C(Nc1ccc(cc1)C)CSc1nnc(n1N)c1(nH)nc2c1CCC2
O=C(Nc1ccc(cc1)C)CSc1nnc(n1N)c1n(nH)c2c1CCC2
ZINC000009088550
ZINC09088550
ZINC9088550

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Available files

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