Vitas-M small molecule compound
methyl 3-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl}-1-benzothiophene-2-carboxylate
Catalog ID
STL095828
SMILES COC(=O)c1sc2c(c1S(=O)(=O)N1CCN(C(C1)C)c1cccc(c1)C)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 C22H24N2O4S2 MW 444.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O4S2/c1-15-7-6-8-17(13-15)24-12-11-23(14-16(24)2)30(26,27)21-18-9-4-5-10-19(18)29-20(21)22(25)28-3/h4-10,13,16H,11-12,14H2,1-3H3InChIKey
JSLMRIYVNSOUSU-UHFFFAOYSA-NSynonyms
899977-61-8899977618
CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=C(SC4=CC=CC=C43)C(=O)OC
InChI=1SC22H24N2O4S2c11576817(1315)24121123(1416(24)2)30(2627)21189451019(18)2920(21)22(25)283h4101316H111214H213H3
methyl3((3methyl4(3methylphenyl)piperazin1yl)sulfonyl)1benzothiophene2carboxylate
METHYL3((3METHYL4(MTOLYL)PIPERAZIN1YL)SULFONYL)BENZO(B)THIOPHENE2CARBOXYLATE
methyl3(3methyl4(3methylphenyl)piperazin1yl)sulfonyl1benzothiophene2carboxylate
MFCD08140890
ZINC000009646416
ZINC000102913440
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