Vitas-M small molecule compound

N-[(1E)-3-[(2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-1-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide

Catalog ID
STK375719
SMILES CCCCN1c2ccccc2/C(=N\NC(=O)/C(=C\c2ccc(c(c2)OC)OC)/NC(=O)c2ccccc2)/C1=O

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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 C30H30N4O5 MW 526.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N4O5/c1-4-5-17-34-24-14-10-9-13-22(24)27(30(34)37)32-33-29(36)23(31-28(35)21-11-7-6-8-12-21)18-20-15-16-25(38-2)26(19-20)39-3/h6-16,18-19H,4-5,17H2,1-3H3,(H,31,35)(H,33,36)/b23-18+,32-27+
InChIKey
CNYROKJFCZWJQX-ZYUOEDNCSA-N
Synonyms

(2E)3(34DIMETHOXYPHENYL)N((1BUTYL2OXOBENZO(D)AZOLIN3YLIDENE)AZAMETHYL)2(PHENYLCARBONYLAMINO)PROP2ENAMIDE
CCCCN1C2=CC=CC=C2C(=NNC(=O)C(=CC3=CC(=C(C=C3)OC)OC)NC(=O)C4=CC=CC=C4)C1=O
CCCCN1c2ccccc2C(=NNC(=O)C(=Cc2ccc(c(c2)OC)OC)NC(=O)c2ccccc2)C1=O
InChI=1SC30H30N4O5c145173424141091322(24)27(30(34)37)323329(36)23(3128(35)21117681221)1820151625(382)26(1920)393h6161819H4517H213H3(H3135)(H3336)b2318+3227+
MFCD01146848
N((1E)3((2E)2(1butyl2oxo12dihydro3Hindol3ylidene)hydrazinyl)1(34dimethoxyphenyl)3oxoprop1en2yl)benzamide
N((E)3((2E)2(1BUTYL2OXOINDOL3YLIDENE)HYDRAZINYL)1(34DIMETHOXYPHENYL)3OXOPROP1EN2YL)BENZAMIDE
ZINC000015938602
ZINC102124262

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Available files

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