Vitas-M small molecule compound
2-({(E)-[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}amino)-N-cyclohexyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK021235
SMILES Clc1cc(ccc1c1ccc(o1)/C=N/c1sc2c(c1C(=O)NC1CCCCC1)CCCC2)[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 C26H26ClN3O4S MW 512.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O4S/c27-21-14-17(30(32)33)10-12-19(21)22-13-11-18(34-22)15-28-26-24(20-8-4-5-9-23(20)35-26)25(31)29-16-6-2-1-3-7-16/h10-16H,1-9H2,(H,29,31)/b28-15+InChIKey
MXTSKJFPZUBEEY-RWPZCVJISA-NSynonyms
2(((E)(5(2chloro4nitrophenyl)furan2yl)methylidene)amino)Ncyclohexyl4567tetrahydro1benzothiophene3carboxamide
2((E)(5(2chloro4nitrophenyl)furan2yl)methylideneamino)Ncyclohexyl4567tetrahydro1benzothiophene3carboxamide
C1CCC(CC1)NC(=O)C2=C(SC3=C2CCCC3)N=CC4=CC=C(O4)C5=C(C=C(C=C5)(N+)(=O)(O))Cl
Clc1cc(ccc1c1ccc(o1)C=Nc1sc2c(c1C(=O)NC1CCCCC1)CCCC2)(N+)(=O)(O)
InChI=1SC26H26ClN3O4Sc27211417(30(32)33)101219(21)22131118(3422)15282624(20845923(20)3526)25(31)29166213716h1016H19H2(H2931)b2815+
MFCD02785399
STK021235
ZINC000013940372
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