Vitas-M small molecule compound
(12aS)-6-phenyl-2-{[(E)-phenylmethylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL542180
SMILES O=C1N(/N=C/c2ccccc2)CC(=O)N2[C@H]1Cc1c(C2c2ccccc2)[nH]c2c1cccc2
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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 C27H22N4O2 MW 434.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O2/c32-24-17-30(28-16-18-9-3-1-4-10-18)27(33)23-15-21-20-13-7-8-14-22(20)29-25(21)26(31(23)24)19-11-5-2-6-12-19/h1-14,16,23,26,29H,15,17H2/b28-16+/t23-,26?/m0/s1InChIKey
RPTRLRALCMUVPZ-XJOPEFDCSA-NSynonyms
956942-62-4(12aS)2((E)benzylideneamino)6phenyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6phenyl2(((E)phenylmethylidene)amino)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6((~(E))benzylideneamino)2phenyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399799
956942624
InChI=1SC27H22N4O2c32241730(28161893141018)27(33)2315212013781422(20)2925(21)26(31(23)24)19115261219h11416232629H1517H2b2816+t2326?m0s1
MFCD04145761
O=C1N(N=Cc2ccccc2)CC(=O)N2(C@H)1Cc1c(C2c2ccccc2)(nH)c2c1cccc2
ZINC000002104140
ZINC000002104144
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