Vitas-M small molecule compound
(4-{3-[(furan-2-ylmethyl)amino]-4-nitrophenyl}piperazin-1-yl)(thiophen-2-yl)methanone
Catalog ID
STK148891
SMILES O=C(c1cccs1)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)[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 C20H20N4O4S MW 412.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4S/c25-20(19-4-2-12-29-19)23-9-7-22(8-10-23)15-5-6-18(24(26)27)17(13-15)21-14-16-3-1-11-28-16/h1-6,11-13,21H,7-10,14H2InChIKey
UBSYDXRTKMMNKY-UHFFFAOYSA-NSynonyms
(4(3((FURAN2YLMETHYL)AMINO)4NITROPHENYL)PIPERAZIN1YL)(THIOPHEN2YL)METHANONE
(4(3(FURAN2YLMETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)THIOPHEN2YLMETHANONE
4(3((2FURYLMETHYL)AMINO)4NITROPHENYL)PIPERAZINYL2THIENYLKETONE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))NCC3=CC=CO3)C(=O)C4=CC=CS4
InChI=1SC20H20N4O4Sc2520(1942122919)239722(81023)155618(24(26)27)17(1315)21141631112816h16111321H71014H2
MFCD02631954
O=C(c1cccs1)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)(N+)(=O)(O)
ZINC000004144115
ZINC04144115
ZINC4144115
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