Vitas-M small molecule compound
N-tert-butyl-3-[(2E)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-{[5-(4-nitrophenyl)furan-2-yl]methylidene}hydrazinyl]propanamide
Catalog ID
STL291113
SMILES O=C(NC(C)(C)C)CCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-]
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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 C25H25N5O6S MW 523.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O6S/c1-25(2,3)27-23(31)14-15-29(24-20-6-4-5-7-22(20)37(34,35)28-24)26-16-19-12-13-21(36-19)17-8-10-18(11-9-17)30(32)33/h4-13,16H,14-15H2,1-3H3,(H,27,31)/b26-16+InChIKey
BCGJZUUHMDJTIM-WGOQTCKBSA-NSynonyms
CC(C)(C)NC(=O)CCN(C1=NS(=O)(=O)C2=CC=CC=C21)N=CC3=CC=C(O3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC25H25N5O6Sc125(23)2723(31)141529(2420645722(20)37(3435)2824)261619121321(3619)1781018(11917)30(32)33h41316H1415H213H3(H2731)b2616+
MFCD03215020
Ntertbutyl3((11dioxo12benzothiazol3yl)((E)(5(4nitrophenyl)furan2yl)methylideneamino)amino)propanamide
Ntertbutyl3((2E)1(11dioxido12benzothiazol3yl)2((5(4nitrophenyl)furan2yl)methylidene)hydrazinyl)propanamide
O=C(NC(C)(C)C)CCN(C1=NS(=O)(=O)c2c1cccc2)N=Cc1ccc(o1)c1ccc(cc1)(N+)(=O)(O)
ZINC000027572085
ZINC34931453
Check stock
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