Vitas-M small molecule compound
N-(butan-2-yl)-2-[(11aS)-1,3-dioxo-5-phenyl-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Catalog ID
STL531236
SMILES CCC(NC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1ccccc1)c1c(C2)c2ccccc2[nH]1)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 C30H28N4O3 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O3/c1-3-18(2)31-28(35)21-14-8-10-16-24(21)34-29(36)25-17-22-20-13-7-9-15-23(20)32-26(22)27(33(25)30(34)37)19-11-5-4-6-12-19/h4-16,18,25,27,32H,3,17H2,1-2H3,(H,31,35)/t18?,25-,27?/m0/s1InChIKey
ZZCCEZNRXCPJOI-DYDBGPTBSA-NSynonyms
956813-40-4~(N)butan2yl2((15~(S))1214dioxo10phenyl81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16403640
956813404
CCC(NC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1ccccc1)c1c(C2)c2ccccc2(nH)1)C
InChI=1SC30H28N4O3c1318(2)3128(35)21148101624(21)3429(36)2517222013791523(20)3226(22)27(33(25)30(34)37)19115461219h41618252732H317H212H3(H3135)t18?2527?m0s1
MFCD06764853
N(butan2yl)2((11aS)13dioxo5phenyl561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
N(secbutyl)2((11aS)13dioxo5phenyl1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
ZINC000008789960
ZINC000008789963
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