Vitas-M small molecule compound
3-(4-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]carbonothioyl}piperazin-1-yl)propanenitrile
Catalog ID
STK847276
SMILES N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1ccc(cc1Cl)[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 C18H17ClN4O3S MW 404.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O3S/c19-15-12-13(23(24)25)2-3-14(15)16-4-5-17(26-16)18(27)22-10-8-21(9-11-22)7-1-6-20/h2-5,12H,1,7-11H2InChIKey
QERNRVHPRHPYOT-UHFFFAOYSA-NSynonyms
579443-34-83(4((5(2chloro4nitrophenyl)furan2yl)carbonothioyl)piperazin1yl)propanenitrile
3(4(5(2CHLORO4NITROPHENYL)FURAN2CARBONOTHIOYL)PIPERAZIN1YL)PROPANENITRILE
3(4(5(2CHLORO4NITROPHENYL)FURAN2CARBOTHIOYL)PIPERAZIN1YL)PROPANENITRILE
579443348
C1CN(CCN1CCC#N)C(=S)C2=CC=C(O2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC18H17ClN4O3Sc19151213(23(24)25)2314(15)164517(2616)18(27)2210821(91122)71620h2512H1711H2
MFCD04032797
N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1ccc(cc1Cl)(N+)(=O)(O)
ZINC000020332543
ZINC20332543
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