Vitas-M small molecule compound

(2S)-N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide

Catalog ID
STL529357
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)[C@H](C(=O)NCCC1=CCCCC1)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 C26H32N4O4 MW 464.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O4/c1-16(23(31)27-13-11-17-7-5-4-6-8-17)30-24(32)26(2)22-19(12-14-29(26)25(30)33)20-15-18(34-3)9-10-21(20)28-22/h7,9-10,15-16,28H,4-6,8,11-14H2,1-3H3,(H,27,31)/t16-,26-/m0/s1
InChIKey
WMYQFZTYYJFAAC-QMTYFTJSSA-N
Synonyms
956157-81-6
(2~(S))~(N)(2(cyclohexen1yl)ethyl)2((2~(S))12methoxy2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)10(15)1113tetraen4yl)propanamide
(2S)N(2(cyclohex1en1yl)ethyl)2((11bS)8methoxy11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)propanamide
(S)N(2(cyclohex1en1yl)ethyl)2((S)8methoxy11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)propanamide
16401384
956157816
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(C3=O)(C@H)(C(=O)NCCC1=CCCCC1)C
InChI=1SC26H32N4O4c116(23(31)271311177546817)3024(32)26(2)2219(121429(26)25(30)33)201518(343)91021(20)2822h7910151628H4681114H213H3(H2731)t1626m0s1
ZINC000012869323
ZINC12869323

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Available files

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