Vitas-M small molecule compound

benzyl N-{(2E)-3-(1,3-benzodioxol-5-yl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}glycinate

Catalog ID
STK805380
SMILES O=C(CNC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)OCc1ccccc1

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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 C26H22N2O6 MW 458.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O6/c29-24(32-16-18-7-3-1-4-8-18)15-27-26(31)21(28-25(30)20-9-5-2-6-10-20)13-19-11-12-22-23(14-19)34-17-33-22/h1-14H,15-17H2,(H,27,31)(H,28,30)/b21-13+
InChIKey
GIAWIUGCWXLORA-FYJGNVAPSA-N
Synonyms
300803-73-0
(3BENZO(13)DIOXOL5YL2BENZOYLAMINOACRYLOYLAMINO)ACETICACIDBENZYLESTER
(E)benzyl2(2benzamido3(benzo(d)(13)dioxol5yl)acrylamido)acetate
300803730
BENZYL2(((E)2BENZAMIDO3(13BENZODIOXOL5YL)PROP2ENOYL)AMINO)ACETATE
benzylN((2E)3(13benzodioxol5yl)2((phenylcarbonyl)amino)prop2enoyl)glycinate
C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NCC(=O)OCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4
InChI=1SC26H22N2O6c2924(3216187314818)152726(31)21(2825(30)2095261020)131911122223(1419)34173322h114H1517H2(H2731)(H2830)b2113+
MFCD00699009
O=C(CNC(=O)C(=Cc1ccc2c(c1)OCO2)NC(=O)c1ccccc1)OCc1ccccc1
PHENYLMETHYL2((2E)3(2HBENZO(34D)13DIOXOLAN5YL)2(PHENYLCARBONYLAMINO)PROP2ENOYLAMINO)ACETATE
ZINC000008926020
ZINC08926020
ZINC8926020

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Available files

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