Vitas-M small molecule compound
1-[4-(3,4-dihydroquinolin-1(2H)-ylsulfonyl)phenyl]-3-(3-nitrophenyl)thiourea
Catalog ID
STK494407
SMILES S=C(Nc1cccc(c1)[N+](=O)[O-])Nc1ccc(cc1)S(=O)(=O)N1CCCc2c1cccc2
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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 C22H20N4O4S2 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O4S2/c27-26(28)19-8-3-7-18(15-19)24-22(31)23-17-10-12-20(13-11-17)32(29,30)25-14-4-6-16-5-1-2-9-21(16)25/h1-3,5,7-13,15H,4,6,14H2,(H2,23,24,31)InChIKey
KKGQJPWJCIPXPV-UHFFFAOYSA-NSynonyms
1(4(34dihydro2Hquinolin1ylsulfonyl)phenyl)3(3nitrophenyl)thiourea
1(4(34dihydroquinolin1(2H)ylsulfonyl)phenyl)3(3nitrophenyl)thiourea
C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC22H20N4O4S2c2726(28)1983718(1519)2422(31)2317101220(131117)32(2930)25144616512921(16)25h13571315H4614H2(H2232431)
MFCD06108847
S=C(Nc1cccc(c1)(N+)(=O)(O))Nc1ccc(cc1)S(=O)(=O)N1CCCc2c1cccc2
ZINC000020533688
ZINC20533688
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