Vitas-M small molecule compound
N-{4-[(2E)-2-(1-carbamothioyl-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl]phenyl}acetamide
Catalog ID
STK087080
SMILES CC(=O)Nc1ccc(cc1)N/N=C/1\C(=NN(C1=O)C(=S)N)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 C18H16N6O2S MW 380.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N6O2S/c1-11(25)20-13-7-9-14(10-8-13)21-22-16-15(12-5-3-2-4-6-12)23-24(17(16)26)18(19)27/h2-10,21H,1H3,(H2,19,27)(H,20,25)/b22-16+InChIKey
QCTJCOQJGJMBRL-CJLVFECKSA-NSynonyms
CC(=O)NC1=CC=C(C=C1)NN=C2C(=NN(C2=O)C(=S)N)C3=CC=CC=C3
CC(=O)Nc1ccc(cc1)NN=C1C(=NN(C1=O)C(=S)N)c1ccccc1
InChI=1SC18H16N6O2Sc111(25)20137914(10813)21221615(125324612)2324(17(16)26)18(19)27h21021H1H3(H21927)(H2025)b2216+
MFCD01078263
N(4((2E)2(1CARBAMOTHIOYL5OXO3PHENYL15DIHYDRO4HPYRAZOL4YLIDENE)HYDRAZINYL)PHENYL)ACETAMIDE
N(4((2E)2(1CARBAMOTHIOYL5OXO3PHENYLPYRAZOL4YLIDENE)HYDRAZINYL)PHENYL)ACETAMIDE
STK087080
ZINC000100507720
ZINC5444068
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