Vitas-M small molecule compound

3-phenyl-2-(propylsulfanyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK831035
SMILES CCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3

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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 C20H22N2OS2 MW 370.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2OS2/c1-2-13-24-20-21-18-17(15-11-7-4-8-12-16(15)25-18)19(23)22(20)14-9-5-3-6-10-14/h3,5-6,9-10H,2,4,7-8,11-13H2,1H3
InChIKey
GTAXMNDJSMIJTH-UHFFFAOYSA-N
Synonyms
351160-93-5
351160935
3phenyl2(propylsulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3phenyl2(propylthio)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3phenyl2propylsulfanyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
CCCSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=CC=C4
InChI=1SC20H22N2OS2c12132420211817(15117481216(15)2518)19(23)22(20)1495361014h356910H24781113H21H3
MFCD01879039
ZINC000002274726
ZINC02274726
ZINC2274726

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Available files

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