Vitas-M small molecule compound

2-{[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile

Catalog ID
STK959493
SMILES COc1ccc(cc1)N1C(=O)CC(C1=O)Sc1nc2CCCCCc2cc1C#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 C22H21N3O3S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S/c1-28-17-9-7-16(8-10-17)25-20(26)12-19(22(25)27)29-21-15(13-23)11-14-5-3-2-4-6-18(14)24-21/h7-11,19H,2-6,12H2,1H3
InChIKey
UVEYFZJKXHNFNP-UHFFFAOYSA-N
Synonyms

2((1(4methoxyphenyl)25dioxopyrrolidin3yl)sulfanyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
2(1(4methoxyphenyl)25dioxopyrrolidin3yl)sulfanyl6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
COC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=NC4=C(CCCCC4)C=C3C#N
InChI=1SC22H21N3O3Sc128179716(81017)2520(26)1219(22(25)27)292115(1323)11145324618(14)2421h71119H2612H21H3
MFCD01993947
ZINC000001009845
ZINC000100631602

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Available files

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