Vitas-M small molecule compound
3-[(2E)-2-(4-butoxybenzylidene)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinyl]-N-cyclohexylpropanamide
Catalog ID
STK181135
SMILES CCCCOc1ccc(cc1)/C=N/N(C1=NS(=O)(=O)c2c1cccc2)CCC(=O)NC1CCCCC1
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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 C27H34N4O4S MW 510.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O4S/c1-2-3-19-35-23-15-13-21(14-16-23)20-28-31(18-17-26(32)29-22-9-5-4-6-10-22)27-24-11-7-8-12-25(24)36(33,34)30-27/h7-8,11-16,20,22H,2-6,9-10,17-19H2,1H3,(H,29,32)/b28-20+InChIKey
DWPRVQNPGNOIRP-VFCFBJKWSA-NSynonyms
3(((E)(4butoxyphenyl)methylideneamino)(11dioxo12benzothiazol3yl)amino)Ncyclohexylpropanamide
3((2E)2(4BUTOXYBENZYLIDENE)1(11DIOXIDO12BENZOTHIAZOL3YL)HYDRAZINYL)NCYCLOHEXYLPROPANAMIDE
CCCCOC1=CC=C(C=C1)C=NN(CCC(=O)NC2CCCCC2)C3=NS(=O)(=O)C4=CC=CC=C43
CCCCOc1ccc(cc1)C=NN(C1=NS(=O)(=O)c2c1cccc2)CCC(=O)NC1CCCCC1
InChI=1SC27H34N4O4Sc123193523151321(141623)202831(181726(32)292295461022)272411781225(24)36(3334)3027h7811162022H269101719H21H3(H2932)b2820+
MFCD03215094
ZINC000009905664
ZINC34931458
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