Vitas-M small molecule compound

N-[(2Z)-3-(1,3-benzodioxol-5-yl)-2-{[(2-chlorophenyl)carbonyl]amino}prop-2-enoyl]glycine

Catalog ID
STK722104
SMILES OC(=O)CNC(=O)/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1Cl

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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 C19H15ClN2O6 MW 402.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN2O6/c20-13-4-2-1-3-12(13)18(25)22-14(19(26)21-9-17(23)24)7-11-5-6-15-16(8-11)28-10-27-15/h1-8H,9-10H2,(H,21,26)(H,22,25)(H,23,24)/b14-7-
InChIKey
AOFNNRJRAISPNR-AUWJEWJLSA-N
Synonyms
332374-10-4
(3BENZO(13)DIOXOL5YL2(2CHLOROBENZOYLAMINO)ACRYLOYLAMINO)ACETICACID
(Z)2(3(benzo(d)(13)dioxol5yl)2(2chlorobenzamido)acrylamido)aceticacid
2(((Z)3(13BENZODIOXOL5YL)2((2CHLOROBENZOYL)AMINO)PROP2ENOYL)AMINO)ACETICACID
2(3(2HBENZO(34D)13DIOXOLEN5YL)(2Z)2((2CHLOROPHENYL)CARBONYLAMINO)PROP2ENOYLAMINO)ACETICACID
332374104
C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NCC(=O)O)NC(=O)C3=CC=CC=C3Cl
InChI=1SC19H15ClN2O6c2013421312(13)18(25)2214(19(26)21917(23)24)711561516(811)28102715h18H910H2(H2126)(H2225)(H2324)b147
MFCD01945288
N((2Z)3(13benzodioxol5yl)2(((2chlorophenyl)carbonyl)amino)prop2enoyl)glycine
OC(=O)CNC(=O)C(=Cc1ccc2c(c1)OCO2)NC(=O)c1ccccc1Cl
ZINC000004859680
ZINC4859680

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Available files

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