Vitas-M small molecule compound

(2Z)-3-oxo-2-[4-(propan-2-yl)benzylidene]-7-[4-(propan-2-yl)phenyl]-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile

Catalog ID
STK536017
SMILES N#CC1=Cn2c(=C(C1c1ccc(cc1)C(C)C)C#N)s/c(=C\c1ccc(cc1)C(C)C)/c2=O

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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 C28H25N3OS MW 451.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3OS/c1-17(2)20-7-5-19(6-8-20)13-25-27(32)31-16-23(14-29)26(24(15-30)28(31)33-25)22-11-9-21(10-12-22)18(3)4/h5-13,16-18,26H,1-4H3/b25-13-
InChIKey
RCMMVDZZXZUZHE-MXAYSNPKSA-N
Synonyms
328071-99-4
(2Z)3oxo2(4(propan2yl)benzylidene)7(4(propan2yl)phenyl)23dihydro7H(13)thiazolo(32a)pyridine68dicarbonitrile
(2Z)3OXO7(4PROPAN2YLPHENYL)2((4PROPAN2YLPHENYL)METHYLIDENE)7H(13)THIAZOLO(32A)PYRIDINE68DICARBONITRILE
(Z)2(4isopropylbenzylidene)7(4isopropylphenyl)3oxo37dihydro2Hthiazolo(32a)pyridine68dicarbonitrile
328071994
CC(C)C1=CC=C(C=C1)C=C2C(=O)N3C=C(C(C(=C3S2)C#N)C4=CC=C(C=C4)C(C)C)C#N
InChI=1SC28H25N3OSc117(2)207519(6820)132527(32)311623(1429)26(24(1530)28(31)3325)2211921(101222)18(3)4h513161826H14H3b2513
MFCD01558043
N#CC1=Cn2c(=C(C1c1ccc(cc1)C(C)C)C#N)sc(=Cc1ccc(cc1)C(C)C)c2=O
ZINC000002217308
ZINC000013739482

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Available files

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