Vitas-M small molecule compound
5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[(2Z)-5-(2-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]pentanamide
Catalog ID
STL536496
SMILES O=C1N[C@@H]2[C@H](N1)[C@@H](SC2)CCCCC(=O)/N=c\1/[nH]nc(s1)CCc1ccccc1
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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 C20H25N5O2S2 MW 431.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O2S2/c26-16(9-5-4-8-15-18-14(12-28-15)21-19(27)23-18)22-20-25-24-17(29-20)11-10-13-6-2-1-3-7-13/h1-3,6-7,14-15,18H,4-5,8-12H2,(H2,21,23,27)(H,22,25,26)/t14-,15-,18-/m0/s1InChIKey
BGHGFEDFFONNAD-MPGHIAIKSA-NSynonyms
5((3~(a)~(S)4~(S)6~(a)~(R))2oxo133~(a)466~(a)hexahydrothieno(34d)imidazol4yl)~(N)(5(2phenylethyl)134thiadiazol2yl)pentanamide
5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)N((2Z)5(2phenylethyl)134thiadiazol2(3H)ylidene)pentanamide
52905119
InChI=1SC20H25N5O2S2c2616(9548151814(122815)2119(27)2318)2220252417(2920)1110136213713h1367141518H45812H2(H2212327)(H222526)t141518m0s1
ZINC000062001393
ZINC62001393
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