Vitas-M small molecule compound
3-chloro-N-{3-[(1E)-1-{2-[(2-oxobenzo[cd]indol-1(2H)-yl)acetyl]hydrazinylidene}ethyl]phenyl}benzamide
Catalog ID
STK085576
SMILES Clc1cccc(c1)C(=O)Nc1cccc(c1)/C(=N/NC(=O)Cn1c(=O)c2c3c1cccc3ccc2)/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 C28H21ClN4O3 MW 496.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21ClN4O3/c1-17(19-8-3-11-22(15-19)30-27(35)20-9-2-10-21(29)14-20)31-32-25(34)16-33-24-13-5-7-18-6-4-12-23(26(18)24)28(33)36/h2-15H,16H2,1H3,(H,30,35)(H,32,34)/b31-17+InChIKey
PBWXGMLLAUGFFR-KBVAKVRCSA-NSynonyms
3CHLORON(3((1E)1(2((2OXOBENZO(CD)INDOL1(2H)YL)ACETYL)HYDRAZINYLIDENE)ETHYL)PHENYL)BENZAMIDE
3chloroN(3((E)CmethylN((2(2oxobenzo(cd)indol1yl)acetyl)amino)carbonimidoyl)phenyl)benzamide
CC(=NNC(=O)CN1C2=CC=CC3=C2C(=CC=C3)C1=O)C4=CC(=CC=C4)NC(=O)C5=CC(=CC=C5)Cl
Clc1cccc(c1)C(=O)Nc1cccc(c1)C(=NNC(=O)Cn1c(=O)c2c3c1cccc3ccc2)C
InChI=1SC28H21ClN4O3c117(19831122(1519)3027(35)20921021(29)1420)313225(34)163324135718641223(26(18)24)28(33)36h215H16H21H3(H3035)(H3234)b3117+
MFCD03985817
STK085576
ZINC000013893901
ZINC96515563
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