Vitas-M small molecule compound

[(3E)-3-(2-{(2E)-3-(3,4-dimethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetic acid

Catalog ID
STK676442
SMILES COc1cc(ccc1OC)/C=C(\C(=O)N/N=C/1\c2ccccc2N(C1=O)CC(=O)O)/NC(=O)c1ccccc1

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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 C28H24N4O7 MW 528.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O7/c1-38-22-13-12-17(15-23(22)39-2)14-20(29-26(35)18-8-4-3-5-9-18)27(36)31-30-25-19-10-6-7-11-21(19)32(28(25)37)16-24(33)34/h3-15H,16H2,1-2H3,(H,29,35)(H,31,36)(H,33,34)/b20-14+,30-25+
InChIKey
ASYREYSIILSOEO-PMGDMPKGSA-N
Synonyms

((3E)3(2((2E)3(34dimethoxyphenyl)2((phenylcarbonyl)amino)prop2enoyl)hydrazinylidene)2oxo23dihydro1Hindol1yl)aceticacid
2((3E)3(((E)2BENZAMIDO3(34DIMETHOXYPHENYL)PROP2ENOYL)HYDRAZINYLIDENE)2OXOINDOL1YL)ACETICACID
2(3(((2E)3(34DIMETHOXYPHENYL)2(PHENYLCARBONYLAMINO)PROP2ENOYLAMINO)AZAMETHYLENE)2OXOBENZO(D)AZOLINYL)ACETICACID
COC1=C(C=C(C=C1)C=C(C(=O)NN=C2C3=CC=CC=C3N(C2=O)CC(=O)O)NC(=O)C4=CC=CC=C4)OC
COc1cc(ccc1OC)C=C(C(=O)NN=C1c2ccccc2N(C1=O)CC(=O)O)NC(=O)c1ccccc1
InChI=1SC28H24N4O7c13822131217(1523(22)392)1420(2926(35)188435918)27(36)3130251910671121(19)32(28(25)37)1624(33)34h315H16H212H3(H2935)(H3136)(H3334)b2014+3025+
MFCD02069366
ZINC000003983776
ZINC3983775

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Available files

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