Vitas-M small molecule compound
(1Z)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-8-methoxy-4,4-dimethyl-1-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Catalog ID
STL510600
SMILES COc1cc2C(=CC(N3c2c(c1)/C(=C\1/SC(=S)NC1=O)/C3=O)(C)C)CN1CCN(CC1)c1ccc(cc1)F
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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 C28H27FN4O3S2 MW 550.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27FN4O3S2/c1-28(2)14-16(15-31-8-10-32(11-9-31)18-6-4-17(29)5-7-18)20-12-19(36-3)13-21-22(26(35)33(28)23(20)21)24-25(34)30-27(37)38-24/h4-7,12-14H,8-11,15H2,1-3H3,(H,30,34,37)/b24-22-InChIKey
AZFPNVKIUIJEMV-GYHWCHFESA-NSynonyms
(1Z)6((4(4fluorophenyl)piperazin1yl)methyl)8methoxy44dimethyl1(4oxo2thioxo13thiazolidin5ylidene)4Hpyrrolo(321ij)quinolin2(1H)one
(5~(Z))5(9((4(4fluorophenyl)piperazin1yl)methyl)6methoxy1111dimethyl2oxo1azatricyclo(6310^(412))dodeca468(12)9tetraen3ylidene)2sulfanylidene13thiazolidin4one
134717244
InChI=1SC28H27FN4O3S2c128(2)1416(153181032(11931)186417(29)5718)201219(363)132122(26(35)33(28)23(20)21)2425(34)3027(37)3824h471214H81115H213H3(H303437)b2422
MFCD31711549
ZINC001554503014
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