Vitas-M small molecule compound

1-cyclopropyl-6-fluoro-7-{4-[(4-fluorophenyl)carbamothioyl]-3-methylpiperazin-1-yl}-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Catalog ID
STK785445
SMILES COc1c(N2CCN(C(C2)C)C(=S)Nc2ccc(cc2)F)c(F)cc2c1n(cc(c2=O)C(=O)O)C1CC1

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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 C26H26F2N4O4S MW 528.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26F2N4O4S/c1-14-12-30(9-10-31(14)26(37)29-16-5-3-15(27)4-6-16)22-20(28)11-18-21(24(22)36-2)32(17-7-8-17)13-19(23(18)33)25(34)35/h3-6,11,13-14,17H,7-10,12H2,1-2H3,(H,29,37)(H,34,35)
InChIKey
XXWVTKABRGAPIY-UHFFFAOYSA-N
Synonyms
714291-18-6
1CYCLOPROPYL6FLUORO7(4((4FLUOROPHENYL)CARBAMOTHIOYL)3METHYLPIPERAZIN1YL)8METHOXY4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
1CYCLOPROPYL6FLUORO7(4((4FLUOROPHENYL)CARBAMOTHIOYL)3METHYLPIPERAZIN1YL)8METHOXY4OXOQUINOLINE3CARBOXYLICACID
1CYCLOPROPYL6FLUORO7(4(4FLUOROPHENYLTHIOCARBAMOYL)3METHYLPIPERAZIN1YL)8METHOXY4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
714291186
CC1CN(CCN1C(=S)NC2=CC=C(C=C2)F)C3=C(C=C4C(=C3OC)N(C=C(C4=O)C(=O)O)C5CC5)F
InChI=1SC26H26F2N4O4Sc1141230(91031(14)26(37)29165315(27)4616)2220(28)111821(24(22)362)32(177817)1319(23(18)33)25(34)35h3611131417H71012H212H3(H2937)(H3435)
MFCD05703664
ZINC000008672663
ZINC000008672665

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Available files

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