Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-[2-(dibenzylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Catalog ID
STK707041
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2)N(Cc1ccccc1)Cc1ccccc1)/c1nc2c(s1)cccc2
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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 C32H23N5OS MW 525.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23N5OS/c33-20-25(31-34-27-15-7-8-16-28(27)39-31)19-26-30(35-29-17-9-10-18-37(29)32(26)38)36(21-23-11-3-1-4-12-23)22-24-13-5-2-6-14-24/h1-19H,21-22H2/b25-19+InChIKey
VWJVENAYNKSQQJ-NCELDCMTSA-NSynonyms
799770-38-0(2E)2(13benzothiazol2yl)3(2(dibenzylamino)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enenitrile
(E)2(13BENZOTHIAZOL2YL)3(2(DIBENZYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
(E)2(benzo(d)thiazol2yl)3(2(dibenzylamino)4oxo4Hpyrido(12a)pyrimidin3yl)acrylonitrile
799770380
C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=C(C(=O)N4C=CC=CC4=N3)C=C(C#N)C5=NC6=CC=CC=C6S5
InChI=1SC32H23N5OSc332025(31342715781628(27)3931)192630(3529179101837(29)32(26)38)36(2123113141223)2224135261424h119H2122H2b2519+
MFCD03671465
N#CC(=Cc1c(nc2n(c1=O)cccc2)N(Cc1ccccc1)Cc1ccccc1)c1nc2c(s1)cccc2
ZINC000100942641
ZINC100942641
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