Vitas-M small molecule compound
2-({(E)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}amino)-N-cyclohexyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK742464
SMILES O=C(c1c(/N=C/c2ccc(o2)c2cc(ccc2Cl)[N+](=O)[O-])sc2c1CCCC2)NC1CCCCC1
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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 C26H26ClN3O4S MW 512.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O4S/c27-21-12-10-17(30(32)33)14-20(21)22-13-11-18(34-22)15-28-26-24(19-8-4-5-9-23(19)35-26)25(31)29-16-6-2-1-3-7-16/h10-16H,1-9H2,(H,29,31)/b28-15+InChIKey
HGCXOPXVEHPWAS-RWPZCVJISA-NSynonyms
(E)2(((5(2chloro5nitrophenyl)furan2yl)methylene)amino)Ncyclohexyl4567tetrahydrobenzo(b)thiophene3carboxamide
2(((E)(5(2chloro5nitrophenyl)furan2yl)methylidene)amino)Ncyclohexyl4567tetrahydro1benzothiophene3carboxamide
2((E)(5(2chloro5nitrophenyl)furan2yl)methylideneamino)Ncyclohexyl4567tetrahydro1benzothiophene3carboxamide
C1CCC(CC1)NC(=O)C2=C(SC3=C2CCCC3)N=CC4=CC=C(O4)C5=C(C=CC(=C5)(N+)(=O)(O))Cl
InChI=1SC26H26ClN3O4Sc2721121017(30(32)33)1420(21)22131118(3422)15282624(19845923(19)3526)25(31)29166213716h1016H19H2(H2931)b2815+
MFCD02190569
O=C(c1c(N=Cc2ccc(o2)c2cc(ccc2Cl)(N+)(=O)(O))sc2c1CCCC2)NC1CCCCC1
ZINC000002295920
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