Vitas-M small molecule compound

2,6-diamino-4-(7-methoxy-1,3-benzodioxol-5-yl)-4H-thiopyran-3,5-dicarbonitrile

Catalog ID
STL434035
SMILES N#CC1=C(N)SC(=C(C1c1cc(OC)c2c(c1)OCO2)C#N)N

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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 C15H12N4O3S MW 328.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N4O3S/c1-20-10-2-7(3-11-13(10)22-6-21-11)12-8(4-16)14(18)23-15(19)9(12)5-17/h2-3,12H,6,18-19H2,1H3
InChIKey
IJXJJWBTZQNAME-UHFFFAOYSA-N
Synonyms

26diamino4(7methoxy13benzodioxol5yl)4Hthiopyran35dicarbonitrile
COC1=CC(=CC2=C1OCO2)C3C(=C(SC(=C3C#N)N)N)C#N
InChI=1SC15H12N4O3Sc1201027(31113(10)2262111)128(416)14(18)2315(19)9(12)517h2312H61819H21H3
MFCD01799034
ZINC000085408657
ZINC85408657

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Available files

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