Vitas-M small molecule compound
2-amino-1-{[(E)-(4-tert-butylphenyl)methylidene]amino}-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STL146092
SMILES CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)C(C)(C)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 C29H36N6O MW 484.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N6O/c1-5-6-7-8-11-18-31-28(36)24-25-27(34-23-13-10-9-12-22(23)33-25)35(26(24)30)32-19-20-14-16-21(17-15-20)29(2,3)4/h9-10,12-17,19H,5-8,11,18,30H2,1-4H3,(H,31,36)/b32-19+InChIKey
LUCCBAOBNFDLCZ-BIZUNTBRSA-NSynonyms
579443-68-8(E)2amino1((4(tertbutyl)benzylidene)amino)Nheptyl1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(4tertbutylphenyl)methylidene)amino)Nheptyl1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(4TERTBUTYLPHENYL)METHYLIDENEAMINO)NHEPTYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
579443688
CCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=C(C=C4)C(C)(C)C)N
CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)C(C)(C)C
InChI=1SC29H36N6Oc1567811183128(36)242527(3423131091222(23)3325)35(26(24)30)321920141621(171520)29(23)4h910121719H58111830H214H3(H3136)b3219+
MFCD04032833
ZINC000002396301
ZINC103157761
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