Vitas-M small molecule compound
N-[2,2,2-trichloro-1-({[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}amino)ethyl]propanamide
Catalog ID
STL527512
SMILES CCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C17H21Cl3N4O2S MW 451.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21Cl3N4O2S/c1-2-13(25)21-15(17(18,19)20)22-16(27)23-7-10-6-11(9-23)12-4-3-5-14(26)24(12)8-10/h3-5,10-11,15H,2,6-9H2,1H3,(H,21,25)(H,22,27)/t10-,11-,15?/m0/s1InChIKey
UKWLZBCJIHPMCC-AKABHXMESA-NSynonyms
956147-88-9~(N)(222trichloro1(((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24diene11carbothioyl)amino)ethyl)propanamide
16398107
956147889
CCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC17H21Cl3N4O2Sc1213(25)2115(17(1819)20)2216(27)23710611(923)1243514(26)24(12)810h35101115H269H21H3(H2125)(H2227)t101115?m0s1
MFCD03660416
N(222trichloro1((((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)carbonothioyl)amino)ethyl)propanamide
N(222trichloro1((1R5R)8oxo234568hexahydro1H15methanopyrido(12a)(15)diazocine3carbothioamido)ethyl)propionamide
ZINC000002140369
ZINC000002140371
Check stock
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