Vitas-M small molecule compound

(11aS)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[4-(propan-2-yl)phenyl]-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione

Catalog ID
STL537807
SMILES CC(c1ccc(cc1)C1N2C(=O)N(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)c1ccc2c(c1)OCCO2)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 C30H27N3O4 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O4/c1-17(2)18-7-9-19(10-8-18)28-27-22(21-5-3-4-6-23(21)31-27)16-24-29(34)32(30(35)33(24)28)20-11-12-25-26(15-20)37-14-13-36-25/h3-12,15,17,24,28,31H,13-14,16H2,1-2H3/t24-,28?/m0/s1
InChIKey
RBRCCZAOWVKESV-ZZDYIDRTSA-N
Synonyms
956915-47-2
(11aS)2(23dihydro14benzodioxin6yl)5(4(propan2yl)phenyl)561111atetrahydro1Himidazo(1516)pyrido(34b)indole13(2H)dione
(11aS)2(23dihydrobenzo(b)(14)dioxin6yl)5(4isopropylphenyl)561111atetrahydro1Himidazo(1516)pyrido(34b)indole13(2H)dione
(15~(S))13(23dihydro14benzodioxin6yl)10(4propan2ylphenyl)81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraene1214dione
16398999
956915472
CC(c1ccc(cc1)C1N2C(=O)N(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)c1ccc2c(c1)OCCO2)C
InChI=1SC30H27N3O4c117(2)187919(10818)282722(21534623(21)3127)162429(34)32(30(35)33(24)28)2011122526(1520)3714133625h3121517242831H131416H212H3t2428?m0s1
MFCD03853330
ZINC000002094751
ZINC000002094754

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Available files

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