Vitas-M small molecule compound
[4-(4-methylphenyl)piperazin-1-yl][5-(3-nitrophenyl)furan-2-yl]methanethione
Catalog ID
STL020948
SMILES Cc1ccc(cc1)N1CCN(CC1)C(=S)c1ccc(o1)c1cccc(c1)[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/c1-16-5-7-18(8-6-16)23-11-13-24(14-12-23)22(29)21-10-9-20(28-21)17-3-2-4-19(15-17)25(26)27/h2-10,15H,11-14H2,1H3InChIKey
KQEPHXNLAPKZRX-UHFFFAOYSA-NSynonyms
327076-93-7(4(4methylphenyl)piperazin1yl)(5(3nitrophenyl)furan2yl)methanethione
(4(4METHYLPHENYL)PIPERAZINYL)(5(3NITROPHENYL)(2FURYL))METHANE1THIONE
(5(3nitrophenyl)furan2yl)(4(ptolyl)piperazin1yl)methanethione
1(4METHYLPHENYL)4((5(3NITROPHENYL)2FURYL)CARBONOTHIOYL)PIPERAZINE
327076937
CC1=CC=C(C=C1)N2CCN(CC2)C(=S)C3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O)
Cc1ccc(cc1)N1CCN(CC1)C(=S)c1ccc(o1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H21N3O3Sc1165718(8616)23111324(141223)22(29)2110920(2821)1732419(1517)25(26)27h21015H1114H21H3
MFCD02108457
ZINC000001213774
ZINC01213774
ZINC1213774
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