Vitas-M small molecule compound
2-methoxy-4-[(E)-{2-[(5-{[(2-methylphenyl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)acetyl]hydrazinylidene}methyl]phenyl thiophene-2-carboxylate
Catalog ID
STK385857
SMILES COc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2C)ccc1OC(=O)c1cccs1
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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 C25H21N5O5S2 MW 535.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O5S2/c1-15-6-3-4-7-17(15)23(32)27-25-30-29-22(37-25)13-21(31)28-26-14-16-9-10-18(19(12-16)34-2)35-24(33)20-8-5-11-36-20/h3-12,14H,13H2,1-2H3,(H,28,31)(H,27,30,32)/b26-14+InChIKey
LHIZREDJRCGMKP-VULFUBBASA-NSynonyms
(2methoxy4((E)((2(5((2methylbenzoyl)amino)134thiadiazol2yl)acetyl)hydrazinylidene)methyl)phenyl)thiophene2carboxylate
2METHOXY4((E)(2((5(((2METHYLPHENYL)CARBONYL)AMINO)134THIADIAZOL2YL)ACETYL)HYDRAZINYLIDENE)METHYL)PHENYLTHIOPHENE2CARBOXYLATE
4((1E)2(2(5((2METHYLPHENYL)CARBONYLAMINO)(134THIADIAZOL2YL))ACETYLAMINO)2AZAVINYL)2METHOXYPHENYLTHIOPHENE2CARBOXYLATE
CC1=CC=CC=C1C(=O)NC2=NN=C(S2)CC(=O)NN=CC3=CC(=C(C=C3)OC(=O)C4=CC=CS4)OC
COc1cc(C=NNC(=O)Cc2nnc(s2)NC(=O)c2ccccc2C)ccc1OC(=O)c1cccs1
InChI=1SC25H21N5O5S2c115634717(15)23(32)2725302922(3725)1321(31)2826141691018(19(1216)342)3524(33)2085113620h31214H13H212H3(H2831)(H273032)b2614+
MFCD03835084
ZINC000059222164
ZINC101895084
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.