Vitas-M small molecule compound
3-(3-phenylpropyl)-2-sulfanyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK438505
SMILES Sc1nc2sc3c(c2c(=O)n1CCCc1ccccc1)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/c23-19-17-15-11-5-2-6-12-16(15)25-18(17)21-20(24)22(19)13-7-10-14-8-3-1-4-9-14/h1,3-4,8-9H,2,5-7,10-13H2,(H,21,24)InChIKey
ZSOWZKKJMXWNDS-UHFFFAOYSA-NSynonyms
3(3phenylpropyl)2sulfanyl356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(3phenylpropyl)2sulfanylidene156789hexahydrocyclohepta(23)thieno(24b)pyrimidin4one
C1CCC2=C(CC1)SC3=C2C(=O)N(C(=S)N3)CCCC4=CC=CC=C4
InChI=1SC20H22N2OS2c23191715115261216(15)2518(17)2120(24)22(19)13710148314914h13489H2571013H2(H2124)
MFCD03945440
ZINC000017076001
ZINC17076001
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