Vitas-M small molecule compound
2-phenylethyl 4-oxo-4-({[2-({4-[(phenylcarbonyl)amino]phenyl}carbonyl)hydrazinyl]carbonothioyl}amino)butanoate
Catalog ID
STL065003
SMILES S=C(NC(=O)CCC(=O)OCCc1ccccc1)NNC(=O)c1ccc(cc1)NC(=O)c1ccccc1
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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 C27H26N4O5S MW 518.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O5S/c32-23(15-16-24(33)36-18-17-19-7-3-1-4-8-19)29-27(37)31-30-26(35)21-11-13-22(14-12-21)28-25(34)20-9-5-2-6-10-20/h1-14H,15-18H2,(H,28,34)(H,30,35)(H2,29,31,32,37)InChIKey
VXYLBBXLQCJVHD-UHFFFAOYSA-NSynonyms
2phenylethyl4(((4benzamidobenzoyl)amino)carbamothioylamino)4oxobutanoate
2phenylethyl4oxo4(((2((4((phenylcarbonyl)amino)phenyl)carbonyl)hydrazinyl)carbonothioyl)amino)butanoate
C1=CC=C(C=C1)CCOC(=O)CCC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3
InChI=1SC27H26N4O5Sc3223(151624(33)361817197314819)2927(37)313026(35)21111322(141221)2825(34)2095261020h114H1518H2(H2834)(H3035)(H229313237)
MFCD05880370
PHENETHYL4(((4BENZAMIDOBENZOYL)AMINO)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
ZINC000012137693
ZINC12137693
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