Vitas-M small molecule compound
1-cyclopropyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxamide
Catalog ID
STK618735
SMILES CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)NC1CCS(=O)(=O)C1
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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 C23H29FN4O4S MW 476.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29FN4O4S/c1-2-26-6-8-27(9-7-26)21-12-20-17(11-19(21)24)22(29)18(13-28(20)16-3-4-16)23(30)25-15-5-10-33(31,32)14-15/h11-13,15-16H,2-10,14H2,1H3,(H,25,30)InChIKey
RXMZQMAENKOCMY-UHFFFAOYSA-NSynonyms
929865-98-51cyclopropylN(11dioxidotetrahydrothiophen3yl)7(4ethylpiperazin1yl)6fluoro4oxo14dihydroquinoline3carboxamide
1cyclopropylN(11dioxothiolan3yl)7(4ethylpiperazin1yl)6fluoro4oxoquinoline3carboxamide
929865985
CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)NC4CCS(=O)(=O)C4)C5CC5)F
InChI=1SC23H29FN4O4Sc12266827(9726)21122017(1119(21)24)22(29)18(1328(20)163416)23(30)251551033(3132)1415h11131516H21014H21H3(H2530)
MFCD09844759
ZINC000009422142
ZINC000009422143
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