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N~2~-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[2-(2-methylpropyl)-1H-benzimidazol-6-yl]glycinamide

Catalog ID
STL542320
SMILES COc1c2c(CCC(c3c2ccc(c(=O)c3)NCC(=O)Nc2ccc3c(c2)[nH]c(n3)CC(C)C)NC(=O)C)cc(c1OC)OC

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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 C34H39N5O6 MW 613.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H39N5O6/c1-18(2)13-30-38-25-11-8-21(15-27(25)39-30)37-31(42)17-35-26-12-9-22-23(16-28(26)41)24(36-19(3)40)10-7-20-14-29(43-4)33(44-5)34(45-6)32(20)22/h8-9,11-12,14-16,18,24H,7,10,13,17H2,1-6H3,(H,35,41)(H,36,40)(H,37,42)(H,38,39)
InChIKey
WHBNPIZYXNLZDH-UHFFFAOYSA-N
Synonyms

(S)2((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2isobutyl1Hbenzo(d)imidazol5yl)acetamide
2((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(2methylpropyl)3~(H)benzimidazol5yl)acetamide
75356998
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)Nc2ccc3c(c2)nc((nH)3)CC(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC34H39N5O6c118(2)1330382511821(1527(25)3930)3731(42)1735261292223(1628(26)41)24(3619(3)40)107201429(434)33(445)34(456)32(20)22h89111214161824H7101317H216H3(H3541)(H3640)(H3742)(H3839)
MFCD31755584
N~2~(7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(2methylpropyl)1Hbenzimidazol6yl)glycinamide
ZINC000108448530
ZINC000206251453

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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