Vitas-M small molecule compound
N-{4-[(2-{[(2E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioyl}hydrazinyl)carbonyl]phenyl}-3-methylbenzamide
Catalog ID
STK139168
SMILES S=C(NC(=O)/C=C/c1ccc(cc1)F)NNC(=O)c1ccc(cc1)NC(=O)c1cccc(c1)C
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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 C25H21FN4O3S MW 476.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21FN4O3S/c1-16-3-2-4-19(15-16)23(32)27-21-12-8-18(9-13-21)24(33)29-30-25(34)28-22(31)14-7-17-5-10-20(26)11-6-17/h2-15H,1H3,(H,27,32)(H,29,33)(H2,28,30,31,34)/b14-7+InChIKey
HFCBUXMDTOYQBP-VGOFMYFVSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C=CC3=CC=C(C=C3)F
InChI=1SC25H21FN4O3Sc11632419(1516)23(32)272112818(91321)24(33)293025(34)2822(31)1471751020(26)11617h215H1H3(H2732)(H2933)(H228303134)b147+
MFCD03596654
N(4((((E)3(4FLUOROPHENYL)PROP2ENOYL)CARBAMOTHIOYLAMINO)CARBAMOYL)PHENYL)3METHYLBENZAMIDE
N(4((2(((2E)3(4FLUOROPHENYL)PROP2ENOYL)CARBAMOTHIOYL)HYDRAZINYL)CARBONYL)PHENYL)3METHYLBENZAMIDE
S=C(NC(=O)C=Cc1ccc(cc1)F)NNC(=O)c1ccc(cc1)NC(=O)c1cccc(c1)C
ZINC000002551639
ZINC02551639
ZINC2551639
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