Vitas-M small molecule compound
(10Z)-10-{[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene}-7-(thiophen-2-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK326001
SMILES Clc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=c/1\sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
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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 C29H18ClN3O4S2 MW 572.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H18ClN3O4S2/c30-17-8-11-20(22(14-17)33(35)36)23-12-9-18(37-23)15-25-28(34)32-27(24-6-3-13-38-24)21-10-7-16-4-1-2-5-19(16)26(21)31-29(32)39-25/h1-6,8-9,11-15,27H,7,10H2/b25-15-InChIKey
JPXMHWGNTBKZTR-MYYYXRDXSA-NSynonyms
(10Z)10((5(4chloro2nitrophenyl)furan2yl)methylidene)7(thiophen2yl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10((5(4chloro2nitrophenyl)furan2yl)methylene)7(thiophen2yl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=CS5)C(=O)C(=CC6=CC=C(O6)C7=C(C=C(C=C7)Cl)(N+)(=O)(O))S4
Clc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)C=c1sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
InChI=1SC29H18ClN3O4S2c301781120(22(1417)33(35)36)2312918(3723)152528(34)3227(2463133824)2110716412519(16)26(21)3129(32)3925h1689111527H710H2b2515
MFCD03665828
ZINC000001751143
ZINC000001751150
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