Vitas-M small molecule compound
2-({3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)-N-[3-(morpholin-4-yl)propyl]hydrazinecarbothioamide
Catalog ID
STL395335
SMILES S=C(NNC(=O)c1cccc(c1)Cn1nc(c(c1C)Br)C)NCCCN1CCOCC1
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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 C21H29BrN6O2S MW 509.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29BrN6O2S/c1-15-19(22)16(2)28(26-15)14-17-5-3-6-18(13-17)20(29)24-25-21(31)23-7-4-8-27-9-11-30-12-10-27/h3,5-6,13H,4,7-12,14H2,1-2H3,(H,24,29)(H2,23,25,31)InChIKey
PHANBGVCAJCMPG-UHFFFAOYSA-NSynonyms
1005701-12-11((3((4BROMO35DIMETHYLPYRAZOL1YL)METHYL)BENZOYL)AMINO)3(3MORPHOLIN4YLPROPYL)THIOUREA
1005701121
2((3((4BROMO35DIMETHYL1HPYRAZOL1YL)METHYL)PHENYL)CARBONYL)N(3(MORPHOLIN4YL)PROPYL)HYDRAZINECARBOTHIOAMIDE
CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NNC(=S)NCCCN3CCOCC3)C)Br
InChI=1SC21H29BrN6O2Sc11519(22)16(2)28(2615)141753618(1317)20(29)242521(31)237482791130121027h35613H471214H212H3(H2429)(H2232531)
MFCD04131506
ZINC000022833720
ZINC22833720
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