Vitas-M small molecule compound

[4-(3-methylphenyl)piperazin-1-yl][5-(2-nitrophenyl)furan-2-yl]methanethione

Catalog ID
STK999637
SMILES Cc1cccc(c1)N1CCN(CC1)C(=S)c1ccc(o1)c1ccccc1[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 C22H21N3O3S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S/c1-16-5-4-6-17(15-16)23-11-13-24(14-12-23)22(29)21-10-9-20(28-21)18-7-2-3-8-19(18)25(26)27/h2-10,15H,11-14H2,1H3
InChIKey
OWTWZYKWGCTZMB-UHFFFAOYSA-N
Synonyms
314260-03-2
(4(3methylphenyl)piperazin1yl)(5(2nitrophenyl)furan2yl)methanethione
(4(3METHYLPHENYL)PIPERAZINYL)(5(2NITROPHENYL)(2FURYL))METHANE1THIONE
(5(2nitrophenyl)furan2yl)(4(mtolyl)piperazin1yl)methanethione
1(3METHYLPHENYL)4((5(2NITROPHENYL)2FURYL)CARBONOTHIOYL)PIPERAZINE
314260032
CC1=CC(=CC=C1)N2CCN(CC2)C(=S)C3=CC=C(O3)C4=CC=CC=C4(N+)(=O)(O)
Cc1cccc(c1)N1CCN(CC1)C(=S)c1ccc(o1)c1ccccc1(N+)(=O)(O)
InChI=1SC22H21N3O3Sc11654617(1516)23111324(141223)22(29)2110920(2821)18723819(18)25(26)27h21015H1114H21H3
MFCD02216848
ZINC000000939660
ZINC00939660
ZINC939660

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Available files

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