Vitas-M small molecule compound
N-[5-(2-{(2E)-2-[3-ethoxy-4-(naphthalen-1-ylmethoxy)benzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]benzamide
Catalog ID
STK531304
SMILES CCOc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)ccc1OCc1cccc2c1cccc2
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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 C31H27N5O4S MW 565.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5O4S/c1-2-39-27-17-21(15-16-26(27)40-20-24-13-8-12-22-9-6-7-14-25(22)24)19-32-34-28(37)18-29-35-36-31(41-29)33-30(38)23-10-4-3-5-11-23/h3-17,19H,2,18,20H2,1H3,(H,34,37)(H,33,36,38)/b32-19+InChIKey
LETIGPCBYMCBPN-BIZUNTBRSA-NSynonyms
(E)N(5(2(2(3ethoxy4(naphthalen1ylmethoxy)benzylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
CCOC1=C(C=CC(=C1)C=NNC(=O)CC2=NN=C(S2)NC(=O)C3=CC=CC=C3)OCC4=CC=CC5=CC=CC=C54
CCOc1cc(C=NNC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)ccc1OCc1cccc2c1cccc2
InChI=1SC31H27N5O4Sc1239271721(151626(27)40202413812229671425(22)24)19323428(37)1829353631(4129)3330(38)23104351123h31719H21820H21H3(H3437)(H333638)b3219+
MFCD02198333
N(5(2((2E)2((3ETHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)HYDRAZINYL)2OXOETHYL)134THIADIAZOL2YL)BENZAMIDE
N(5(2((2E)2(3ethoxy4(naphthalen1ylmethoxy)benzylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
ZINC000011419619
ZINC58993747
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