Vitas-M small molecule compound

N-[4-(acetylamino)phenyl]-2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Catalog ID
STK575603
SMILES O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc(n1N)c1cc([nH]n1)c1ccc(cc1)Cl

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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 C21H19ClN8O2S MW 482.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN8O2S/c1-12(31)24-15-6-8-16(9-7-15)25-19(32)11-33-21-29-28-20(30(21)23)18-10-17(26-27-18)13-2-4-14(22)5-3-13/h2-10H,11,23H2,1H3,(H,24,31)(H,25,32)(H,26,27)
InChIKey
LGMSAFOJMCXPBE-UHFFFAOYSA-N
Synonyms
879462-37-0
879462370
CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=NN3)C4=CC=C(C=C4)Cl
InChI=1SC21H19ClN8O2Sc112(31)24156816(9715)2519(32)113321292820(30(21)23)181017(262718)132414(22)5313h210H1123H21H3(H2431)(H2532)(H2627)
MFCD07208486
N(4(acetylamino)phenyl)2((4amino5(5(4chlorophenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)acetamide
N(4(ACETYLAMINO)PHENYL)2(4AMINO5(3(4CHLOROPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(4ACETAMIDOPHENYL)2((4AMINO5(3(4CHLOROPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4acetamidophenyl)2((4amino5(3(4chlorophenyl)1Hpyrazol5yl)4H124triazol3yl)thio)acetamide
O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)Cl
O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc(n1N)c1cc((nH)n1)c1ccc(cc1)Cl
ZINC000009450410
ZINC09450410
ZINC9450410

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Available files

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