Vitas-M small molecule compound
2-{[4-amino-5-(3-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-benzodioxol-5-ylmethyl)acetamide
Catalog ID
STK987522
SMILES O=C(NCc1ccc2c(c1)OCO2)CSc1nnc(n1N)c1cccc(c1)F
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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 C18H16FN5O3S MW 401.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FN5O3S/c19-13-3-1-2-12(7-13)17-22-23-18(24(17)20)28-9-16(25)21-8-11-4-5-14-15(6-11)27-10-26-14/h1-7H,8-10,20H2,(H,21,25)InChIKey
FMSQDWMHVGJHEA-UHFFFAOYSA-NSynonyms
852221-30-82((4AMINO5(3FLUOROPHENYL)124TRIAZOL3YL)SULFANYL)N(13BENZODIOXOL5YLMETHYL)ACETAMIDE
2((4amino5(3fluorophenyl)4H124triazol3yl)sulfanyl)N(13benzodioxol5ylmethyl)acetamide
852221308
C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NN=C(N3N)C4=CC(=CC=C4)F
InChI=1SC18H16FN5O3Sc191331212(713)17222318(24(17)20)28916(25)21811451415(611)27102614h17H81020H2(H2125)
MFCD06674682
ZINC000003446110
ZINC03446110
ZINC3446110
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Check stock on Vitas-MAvailable files
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