Vitas-M small molecule compound
2-phenylethyl 4-{[(2-{4-[(3,4-dimethylphenyl)amino]-4-oxobutanoyl}hydrazinyl)carbonothioyl]amino}-4-oxobutanoate
Catalog ID
STL065001
SMILES O=C(NC(=S)NNC(=O)CCC(=O)Nc1ccc(c(c1)C)C)CCC(=O)OCCc1ccccc1
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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 C25H30N4O5S MW 498.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O5S/c1-17-8-9-20(16-18(17)2)26-21(30)10-11-23(32)28-29-25(35)27-22(31)12-13-24(33)34-15-14-19-6-4-3-5-7-19/h3-9,16H,10-15H2,1-2H3,(H,26,30)(H,28,32)(H2,27,29,31,35)InChIKey
YOQNXRXGVPHZDX-UHFFFAOYSA-NSynonyms
2phenylethyl4(((2(4((34dimethylphenyl)amino)4oxobutanoyl)hydrazinyl)carbonothioyl)amino)4oxobutanoate
2phenylethyl4(((4(34dimethylanilino)4oxobutanoyl)amino)carbamothioylamino)4oxobutanoate
CC1=C(C=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)CCC(=O)OCCC2=CC=CC=C2)C
InChI=1SC25H30N4O5Sc1178920(1618(17)2)2621(30)101123(32)282925(35)2722(31)121324(33)341514196435719h3916H1015H212H3(H2630)(H2832)(H227293135)
MFCD05880343
PHENETHYL4(((4(34DIMETHYLANILINO)4OXOBUTANOYL)AMINO)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
ZINC000012137587
ZINC12137587
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