Vitas-M small molecule compound

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

Catalog ID
STK570991
SMILES COc1cccc(c1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)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 C20H18ClN7O2S MW 455.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN7O2S/c1-30-15-4-2-3-14(9-15)23-18(29)11-31-20-27-26-19(28(20)22)17-10-16(24-25-17)12-5-7-13(21)8-6-12/h2-10H,11,22H2,1H3,(H,23,29)(H,24,25)
InChIKey
IXAHWTKNNWIBAF-UHFFFAOYSA-N
Synonyms
879451-28-2
2((4AMINO5(3(4CHLOROPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(3METHOXYPHENYL)ACETAMIDE
2((4amino5(3(4chlorophenyl)1Hpyrazol5yl)4H124triazol3yl)thio)N(3methoxyphenyl)acetamide
2((4amino5(5(4chlorophenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N(3methoxyphenyl)acetamide
2(4AMINO5(3(4CHLOROPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(3METHOXYPHENYL)ACETAMIDE
879451282
COC1=CC=CC(=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=NN3)C4=CC=C(C=C4)Cl
COc1cccc(c1)NC(=O)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)Cl
COc1cccc(c1)NC(=O)CSc1nnc(n1N)c1n(nH)c(c1)c1ccc(cc1)Cl
InChI=1SC20H18ClN7O2Sc1301542314(915)2318(29)113120272619(28(20)22)171016(242517)125713(21)8612h210H1122H21H3(H2329)(H2425)
MFCD07204877
ZINC000009452527
ZINC09452527
ZINC9452527

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Available files

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