Vitas-M small molecule compound

4-(furan-2-ylcarbonyl)-N-(3-nitrophenyl)piperazine-1-carbothioamide

Catalog ID
STK464482
SMILES S=C(N1CCN(CC1)C(=O)c1ccco1)Nc1cccc(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 C16H16N4O4S MW 360.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O4S/c21-15(14-5-2-10-24-14)18-6-8-19(9-7-18)16(25)17-12-3-1-4-13(11-12)20(22)23/h1-5,10-11H,6-9H2,(H,17,25)
InChIKey
BKLIWSVFCJJQLN-UHFFFAOYSA-N
Synonyms

2FURYL4(((3NITROPHENYL)AMINO)THIOXOMETHYL)PIPERAZINYLKETONE
4(2FUROYL)N(3NITROPHENYL)1PIPERAZINECARBOTHIOAMIDE
4(FURAN2CARBONYL)N(3NITROPHENYL)PIPERAZINE1CARBOTHIOAMIDE
4(furan2ylcarbonyl)N(3nitrophenyl)piperazine1carbothioamide
C1CN(CCN1C(=O)C2=CC=CO2)C(=S)NC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC16H16N4O4Sc2115(1452102414)186819(9718)16(25)171231413(1112)20(22)23h151011H69H2(H1725)
MFCD04226949
ZINC000001117999
ZINC01117999
ZINC1117999

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Available files

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