Vitas-M small molecule compound

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

Catalog ID
STK572828
SMILES O=C(Nc1cccc(c1)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

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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 C20H18ClN7OS MW 439.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN7OS/c1-12-5-7-13(8-6-12)16-10-17(25-24-16)19-26-27-20(28(19)22)30-11-18(29)23-15-4-2-3-14(21)9-15/h2-10H,11,22H2,1H3,(H,23,29)(H,24,25)
InChIKey
IAZHPECMVJPUJB-UHFFFAOYSA-N
Synonyms
1039010-81-5
1039010815
2((4AMINO5(3(4METHYLPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(3CHLOROPHENYL)ACETAMIDE
2((4amino5(3(ptolyl)1Hpyrazol5yl)4H124triazol3yl)thio)N(3chlorophenyl)acetamide
2((4amino5(5(4methylphenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N(3chlorophenyl)acetamide
2(4AMINO5(3(4METHYLPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(3CHLOROPHENYL)ACETAMIDE
CC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)NC4=CC(=CC=C4)Cl
InChI=1SC20H18ClN7OSc1125713(8612)161017(252416)19262720(28(19)22)301118(29)231542314(21)915h210H1122H21H3(H2329)(H2425)
MFCD07198453
O=C(Nc1cccc(c1)Cl)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)C
O=C(Nc1cccc(c1)Cl)CSc1nnc(n1N)c1n(nH)c(c1)c1ccc(cc1)C
ZINC000009487490
ZINC09487490
ZINC9487490

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Available files

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