Vitas-M small molecule compound
methyl 2-{[N-(3-bromophenyl)-N-(phenylsulfonyl)glycyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK358132
SMILES COC(=O)c1c(NC(=O)CN(S(=O)(=O)c2ccccc2)c2cccc(c2)Br)sc2c1CCCC2
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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 C24H23BrN2O5S2 MW 563.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23BrN2O5S2/c1-32-24(29)22-19-12-5-6-13-20(19)33-23(22)26-21(28)15-27(17-9-7-8-16(25)14-17)34(30,31)18-10-3-2-4-11-18/h2-4,7-11,14H,5-6,12-13,15H2,1H3,(H,26,28)InChIKey
XENVSQHRHQMKAX-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN(C3=CC(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4
InChI=1SC24H23BrN2O5S2c13224(29)221912561320(19)3323(22)2621(28)1527(1797816(25)1417)34(3031)18103241118h2471114H56121315H21H3(H2628)
methyl2((2(N(benzenesulfonyl)3bromoanilino)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((N(3bromophenyl)N(phenylsulfonyl)glycyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD04089129
ZINC000000982920
ZINC00982920
ZINC982920
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