Vitas-M small molecule compound

N-{[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]carbonothioyl}thiophene-2-carboxamide

Catalog ID
STK259569
SMILES S=C(N1CCN(CC1)c1c(Cl)cccc1[N+](=O)[O-])NC(=O)c1cccs1

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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 C16H15ClN4O3S2 MW 410.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN4O3S2/c17-11-3-1-4-12(21(23)24)14(11)19-6-8-20(9-7-19)16(25)18-15(22)13-5-2-10-26-13/h1-5,10H,6-9H2,(H,18,22,25)
InChIKey
CNIGBTUTULUDBP-UHFFFAOYSA-N
Synonyms

C1CN(CCN1C2=C(C=CC=C2Cl)(N+)(=O)(O))C(=S)NC(=O)C3=CC=CS3
InChI=1SC16H15ClN4O3S2c171131412(21(23)24)14(11)196820(9719)16(25)1815(22)1352102613h1510H69H2(H182225)
MFCD04332026
N((4(2CHLORO6NITROPHENYL)1PIPERAZINYL)CARBONOTHIOYL)2THIOPHENECARBOXAMIDE
N((4(2CHLORO6NITROPHENYL)1PIPERAZINYL)SULFANYLIDENEMETHYL)2THIOPHENECARBOXAMIDE
N((4(2chloro6nitrophenyl)piperazin1yl)carbonothioyl)thiophene2carboxamide
N(4(2CHLORANYL6NITROPHENYL)PIPERAZIN1YL)CARBOTHIOYLTHIOPHENE2CARBOXAMIDE
N(4(2CHLORO6NITROPHENYL)PIPERAZINE1CARBOTHIOYL)THIOPHENE2CARBOXAMIDE
S=C(N1CCN(CC1)c1c(Cl)cccc1(N+)(=O)(O))NC(=O)c1cccs1
ZINC000004998756
ZINC04998756
ZINC4998756

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.