Vitas-M small molecule compound

N'-{(E)-[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4-[(4-phenyl-1,3-thiazol-2-yl)amino]benzohydrazide

Catalog ID
STK387804
SMILES O=C(c1ccc(cc1)Nc1scc(n1)c1ccccc1)N/N=C/c1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C

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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 C29H23Cl2N5OS MW 560.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23Cl2N5OS/c1-18-14-22(19(2)36(18)24-12-13-25(30)26(31)15-24)16-32-35-28(37)21-8-10-23(11-9-21)33-29-34-27(17-38-29)20-6-4-3-5-7-20/h3-17H,1-2H3,(H,33,34)(H,35,37)/b32-16+
InChIKey
PWWHHNGSICWCSO-KPGMTVGESA-N
Synonyms

CC1=CC(=C(N1C2=CC(=C(C=C2)Cl)Cl)C)C=NNC(=O)C3=CC=C(C=C3)NC4=NC(=CS4)C5=CC=CC=C5
InChI=1SC29H23Cl2N5OSc1181422(19(2)36(18)24121325(30)26(31)1524)16323528(37)2181023(11921)33293427(173829)206435720h317H12H3(H3334)(H3537)b3216+
MFCD01874075
N((1E)2(1(34DICHLOROPHENYL)25DIMETHYLPYRROL3YL)1AZAVINYL)(4((4PHENYL(13THIAZOL2YL))AMINO)PHENYL)CARBOXAMIDE
N((E)(1(34DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)4((4PHENYL13THIAZOL2YL)AMINO)BENZOHYDRAZIDE
N((E)(1(34dichlorophenyl)25dimethylpyrrol3yl)methylideneamino)4((4phenyl13thiazol2yl)amino)benzamide
O=C(c1ccc(cc1)Nc1scc(n1)c1ccccc1)NN=Cc1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C
ZINC000004062670
ZINC100120778

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Available files

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