Vitas-M small molecule compound
methyl 3-[(4'-carbamoyl-1,4'-bipiperidin-1'-yl)sulfonyl]-1-benzothiophene-2-carboxylate
Catalog ID
STL095821
SMILES COC(=O)c1sc2c(c1S(=O)(=O)N1CCC(CC1)(C(=O)N)N1CCCCC1)cccc2
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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 C21H27N3O5S2 MW 465.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O5S2/c1-29-19(25)17-18(15-7-3-4-8-16(15)30-17)31(27,28)24-13-9-21(10-14-24,20(22)26)23-11-5-2-6-12-23/h3-4,7-8H,2,5-6,9-14H2,1H3,(H2,22,26)InChIKey
RJEDLDLQIZJYIV-UHFFFAOYSA-NSynonyms
899978-14-4899978144
COC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)N3CCC(CC3)(C(=O)N)N4CCCCC4
InChI=1SC21H27N3O5S2c12919(25)1718(15734816(15)3017)31(2728)2413921(10142420(22)26)23115261223h3478H256914H21H3(H22226)
METHYL3((4(AMINOCARBONYL)14BIPIPERIDIN1YL)SULFONYL)1BENZOTHIOPHENE2CARBOXYLATE
methyl3((4carbamoyl14bipiperidin1yl)sulfonyl)1benzothiophene2carboxylate
methyl3(4carbamoyl4piperidin1ylpiperidin1yl)sulfonyl1benzothiophene2carboxylate
MFCD08140950
ZINC000017043421
ZINC17043421
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