Vitas-M small molecule compound
3-chloro-N'-[(E)-{5-[(4-chloro-3-methylphenoxy)methyl]furan-2-yl}methylidene]-6-nitro-1-benzothiophene-2-carbohydrazide
Catalog ID
STK452846
SMILES O=C(c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-])N/N=C/c1ccc(o1)COc1ccc(c(c1)C)Cl
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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 C22H15Cl2N3O5S MW 504.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15Cl2N3O5S/c1-12-8-14(5-7-18(12)23)31-11-16-4-3-15(32-16)10-25-26-22(28)21-20(24)17-6-2-13(27(29)30)9-19(17)33-21/h2-10H,11H2,1H3,(H,26,28)/b25-10+InChIKey
CQJHEPBXOYBWJZ-KIBLKLHPSA-NSynonyms
3CHLORON((5((4CHLORO3METHYLPHENOXY)METHYL)2FURYL)METHYLENE)6NITRO1BENZOTHIOPHENE2CARBOHYDRAZIDE
3chloroN((E)(5((4chloro3methylphenoxy)methyl)furan2yl)methylidene)6nitro1benzothiophene2carbohydrazide
3chloroN((E)(5((4chloro3methylphenoxy)methyl)furan2yl)methylideneamino)6nitro1benzothiophene2carboxamide
CC1=C(C=CC(=C1)OCC2=CC=C(O2)C=NNC(=O)C3=C(C4=C(S3)C=C(C=C4)(N+)(=O)(O))Cl)Cl
InChI=1SC22H15Cl2N3O5Sc112814(5718(12)23)3111164315(3216)10252622(28)2120(24)176213(27(29)30)919(17)3321h210H11H21H3(H2628)b2510+
MFCD02605952
N((1E)2(5((4CHLORO3METHYLPHENOXY)METHYL)(2FURYL))1AZAVINYL)(3CHLORO6NITROBENZO(B)THIOPHEN2YL)CARBOXAMIDE
O=C(c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O))NN=Cc1ccc(o1)COc1ccc(c(c1)C)Cl
ZINC000002759749
ZINC33742979
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