Vitas-M small molecule compound

(5E)-2-[4-(2-nitrophenyl)piperazin-1-yl]-5-[4-(propan-2-yloxy)benzylidene]-1,3-thiazol-4(5H)-one

Catalog ID
STK769065
SMILES CC(Oc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-])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 C23H24N4O4S MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O4S/c1-16(2)31-18-9-7-17(8-10-18)15-21-22(28)24-23(32-21)26-13-11-25(12-14-26)19-5-3-4-6-20(19)27(29)30/h3-10,15-16H,11-14H2,1-2H3/b21-15+
InChIKey
IJXNXRXZUZXVST-RCCKNPSSSA-N
Synonyms
383894-54-0
(5E)2(4(2NITROPHENYL)PIPERAZIN1YL)5((4PROPAN2YLOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5E)2(4(2nitrophenyl)piperazin1yl)5(4(propan2yloxy)benzylidene)13thiazol4(5H)one
(E)5(4isopropoxybenzylidene)2(4(2nitrophenyl)piperazin1yl)thiazol4(5H)one
383894540
5((4(METHYLETHOXY)PHENYL)METHYLENE)2(4(2NITROPHENYL)PIPERAZINYL)13THIAZOLIN4ONE
CC(C)OC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)C4=CC=CC=C4(N+)(=O)(O)
CC(Oc1ccc(cc1)C=C1SC(=NC1=O)N1CCN(CC1)c1ccccc1(N+)(=O)(O))C
InChI=1SC23H24N4O4Sc116(2)31189717(81018)152122(28)2423(3221)26131125(121426)19534620(19)27(29)30h3101516H1114H212H3b2115+
MFCD03000670
ZINC000008846678
ZINC08846678
ZINC8846678

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Available files

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