Vitas-M small molecule compound
methyl 2-{[(4-methylpiperazin-1-yl)acetyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK478222
SMILES COC(=O)c1c(NC(=O)CN2CCN(CC2)C)sc2c1CCCCCC2
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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 C19H29N3O3S MW 379.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H29N3O3S/c1-21-9-11-22(12-10-21)13-16(23)20-18-17(19(24)25-2)14-7-5-3-4-6-8-15(14)26-18/h3-13H2,1-2H3,(H,20,23)InChIKey
PWKGYPQQFWSAFW-UHFFFAOYSA-NSynonyms
CN1CCN(CC1)CC(=O)NC2=C(C3=C(S2)CCCCCC3)C(=O)OC
InChI=1SC19H29N3O3Sc12191122(121021)1316(23)201817(19(24)252)1475346815(14)2618h313H212H3(H2023)
methyl2(((4methylpiperazin1yl)acetyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((2(4methylpiperazin1yl)acetyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD06081284
ZINC000020220139
ZINC20220139
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