Vitas-M small molecule compound

(10Z)-7-(4-fluorophenyl)-10-[3-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one

Catalog ID
STK085278
SMILES COc1cc(ccc1OCc1cccc2c1cccc2)/C=c/1\sc2=NC3=C(C(n2c1=O)c1ccc(cc1)F)CCc1c3cccc1

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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 C39H29FN2O3S MW 624.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H29FN2O3S/c1-44-34-21-24(13-20-33(34)45-23-28-10-6-9-25-7-2-4-11-30(25)28)22-35-38(43)42-37(27-14-17-29(40)18-15-27)32-19-16-26-8-3-5-12-31(26)36(32)41-39(42)46-35/h2-15,17-18,20-22,37H,16,19,23H2,1H3/b35-22-
InChIKey
QHRNDZPNYYXTDR-QHDYCIAZSA-N
Synonyms

(10Z)7(4FLUOROPHENYL)10(3METHOXY4(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
(Z)7(4fluorophenyl)10(3methoxy4(naphthalen1ylmethoxy)benzylidene)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
COC1=C(C=CC(=C1)C=C2C(=O)N3C(C4=C(C5=CC=CC=C5CC4)N=C3S2)C6=CC=C(C=C6)F)OCC7=CC=CC8=CC=CC=C87
COc1cc(ccc1OCc1cccc2c1cccc2)C=c1sc2=NC3=C(C(n2c1=O)c1ccc(cc1)F)CCc1c3cccc1
InChI=1SC39H29FN2O3Sc144342124(132033(34)4523281069257241130(25)28)223538(43)4237(27141729(40)181527)321916268351231(26)36(32)4139(42)4635h2151718202237H161923H21H3b3522
MFCD03664025
STK085278
ZINC000097959124
ZINC000097959125

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Available files

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