Vitas-M small molecule compound
2-{[4-amino-5-(3-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Catalog ID
STK987467
SMILES O=C(CSc1nnc(n1N)c1cccc(c1)F)NCCC1=CCCCC1
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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 C18H22FN5OS MW 375.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22FN5OS/c19-15-8-4-7-14(11-15)17-22-23-18(24(17)20)26-12-16(25)21-10-9-13-5-2-1-3-6-13/h4-5,7-8,11H,1-3,6,9-10,12,20H2,(H,21,25)InChIKey
RXVLDAOAZCHOOS-UHFFFAOYSA-NSynonyms
2((4AMINO5(3FLUOROPHENYL)124TRIAZOL3YL)SULFANYL)N(2(CYCLOHEXEN1YL)ETHYL)ACETAMIDE
2((4amino5(3fluorophenyl)4H124triazol3yl)sulfanyl)N(2(cyclohex1en1yl)ethyl)acetamide
C1CCC(=CC1)CCNC(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)F
InChI=1SC18H22FN5OSc191584714(1115)17222318(24(17)20)261216(25)21109135213613h457811H1369101220H2(H2125)
MFCD18184224
ZINC000005675167
ZINC05675167
ZINC5675167
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