Vitas-M small molecule compound

benzyl N-{(2E)-2-[(phenylcarbonyl)amino]-3-[4-(propan-2-yloxy)phenyl]prop-2-enoyl}glycinate

Catalog ID
STK699774
SMILES O=C(CNC(=O)/C(=C\c1ccc(cc1)OC(C)C)/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 C28H28N2O5 MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O5/c1-20(2)35-24-15-13-21(14-16-24)17-25(30-27(32)23-11-7-4-8-12-23)28(33)29-18-26(31)34-19-22-9-5-3-6-10-22/h3-17,20H,18-19H2,1-2H3,(H,29,33)(H,30,32)/b25-17+
InChIKey
WDNSGTKLRLLEMH-KOEQRZSOSA-N
Synonyms
304870-96-0
(2BENZOYLAMINO3(4ISOPROPOXYPHENYL)ACRYLOYLAMINO)ACETICACIDBENZYLESTER
(E)benzyl2(2benzamido3(4isopropoxyphenyl)acrylamido)acetate
304870960
BENZYL2(((E)2BENZAMIDO3(4PROPAN2YLOXYPHENYL)PROP2ENOYL)AMINO)ACETATE
BENZYL2((2E)2(PHENYLFORMAMIDO)3(4(PROPAN2YLOXY)PHENYL)PROP2ENAMIDO)ACETATE
benzylN((2E)2((phenylcarbonyl)amino)3(4(propan2yloxy)phenyl)prop2enoyl)glycinate
CC(C)OC1=CC=C(C=C1)C=C(C(=O)NCC(=O)OCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3
InChI=1SC28H28N2O5c120(2)3524151321(141624)1725(3027(32)23117481223)28(33)291826(31)34192295361022h31720H1819H212H3(H2933)(H3032)b2517+
MFCD00699084
O=C(CNC(=O)C(=Cc1ccc(cc1)OC(C)C)NC(=O)c1ccccc1)OCc1ccccc1
PHENYLMETHYL2((2E)3(4(METHYLETHOXY)PHENYL)2(PHENYLCARBONYLAMINO)PROP2ENOYLAMINO)ACETATE
ZINC000013511756
ZINC13511756

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Available files

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