Vitas-M small molecule compound
ethyl ({6-[({[4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-1,3-benzothiazol-2-yl}sulfanyl)acetate
Catalog ID
STK765657
SMILES CCOC(=O)CSc1nc2c(s1)cc(cc2)NC(=O)CSc1nnc(n1C)c1cccc(c1)[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 C22H20N6O5S3 MW 544.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N6O5S3/c1-3-33-19(30)12-35-22-24-16-8-7-14(10-17(16)36-22)23-18(29)11-34-21-26-25-20(27(21)2)13-5-4-6-15(9-13)28(31)32/h4-10H,3,11-12H2,1-2H3,(H,23,29)InChIKey
FSJSOHGUDSODTC-UHFFFAOYSA-NSynonyms
381677-62-9381677629
CCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=NN=C(N3C)C4=CC(=CC=C4)(N+)(=O)(O)
CCOC(=O)CSc1nc2c(s1)cc(cc2)NC(=O)CSc1nnc(n1C)c1cccc(c1)(N+)(=O)(O)
ethyl((6((((4methyl5(3nitrophenyl)4H124triazol3yl)sulfanyl)acetyl)amino)13benzothiazol2yl)sulfanyl)acetate
ETHYL2((6((2((4METHYL5(3NITROPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)13BENZOTHIAZOL2YL)SULFANYL)ACETATE
ethyl2((6(2((4methyl5(3nitrophenyl)4H124triazol3yl)thio)acetamido)benzo(d)thiazol2yl)thio)acetate
ETHYL2(6(2(4METHYL5(3NITROPHENYL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOTHIAZOL2YLTHIO)ACETATE
InChI=1SC22H20N6O5S3c133319(30)12352224168714(1017(16)3622)2318(29)113421262520(27(21)2)1354615(913)28(31)32h410H31112H212H3(H2329)
MFCD02614771
ZINC000002318594
ZINC2318594
Check stock
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Check stock on Vitas-MAvailable files
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