Vitas-M small molecule compound
2-amino-1-{[(E)-(4-ethoxyphenyl)methylidene]amino}-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK714555
SMILES CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)OCC
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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 C27H32N6O2 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N6O2/c1-3-5-6-7-10-17-29-27(34)23-24-26(32-22-12-9-8-11-21(22)31-24)33(25(23)28)30-18-19-13-15-20(16-14-19)35-4-2/h8-9,11-16,18H,3-7,10,17,28H2,1-2H3,(H,29,34)/b30-18+InChIKey
OVKUDINIOWZZDJ-UXHLAJHPSA-NSynonyms
586990-91-2(E)2amino1((4ethoxybenzylidene)amino)Nheptyl1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(4ethoxyphenyl)methylidene)amino)Nheptyl1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(4ETHOXYPHENYL)METHYLIDENEAMINO)NHEPTYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
586990912
CCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=C(C=C4)OCC)N
CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)OCC
InChI=1SC27H32N6O2c1356710172927(34)232426(322212981121(22)3124)33(25(23)28)301819131520(161419)3542h89111618H37101728H212H3(H2934)b3018+
MFCD04032963
ZINC000002396451
ZINC102672289
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