Vitas-M small molecule compound
2-{[(4-fluorophenyl)(methylsulfonyl)amino]acetyl}-N-(prop-2-en-1-yl)hydrazinecarbothioamide (non-preferred name)
Catalog ID
STL365701
SMILES C=CCNC(=S)NNC(=O)CN(S(=O)(=O)C)c1ccc(cc1)F
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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 C13H17FN4O3S2 MW 360.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17FN4O3S2/c1-3-8-15-13(22)17-16-12(19)9-18(23(2,20)21)11-6-4-10(14)5-7-11/h3-7H,1,8-9H2,2H3,(H,16,19)(H2,15,17,22)InChIKey
DQADMMKXNUYOPA-UHFFFAOYSA-NSynonyms
1((2(4fluoroNmethylsulfonylanilino)acetyl)amino)3prop2enylthiourea
2(((4fluorophenyl)(methylsulfonyl)amino)acetyl)N(prop2en1yl)hydrazinecarbothioamide(nonpreferredname)
CS(=O)(=O)N(CC(=O)NNC(=S)NCC=C)C1=CC=C(C=C1)F
InChI=1SC13H17FN4O3S2c1381513(22)171612(19)918(23(220)21)116410(14)5711h37H189H22H3(H1619)(H2151722)
MFCD28951378
ZINC000020416365
ZINC20416365
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