Vitas-M small molecule compound
3-({[3-(3-ethoxypropyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STL106581
SMILES CCOCCCn1c(SCc2cccc(c2)C#N)nc2c(c1=O)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 C21H21N3O2S MW 379.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O2S/c1-2-26-12-6-11-24-20(25)18-9-3-4-10-19(18)23-21(24)27-15-17-8-5-7-16(13-17)14-22/h3-5,7-10,13H,2,6,11-12,15H2,1H3InChIKey
BXTSYIZFZIAIQB-UHFFFAOYSA-NSynonyms
3(((3(3ethoxypropyl)4oxo34dihydroquinazolin2yl)sulfanyl)methyl)benzonitrile
3((3(3ETHOXYPROPYL)4OXOQUINAZOLIN2YL)SULFANYLMETHYL)BENZONITRILE
CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC(=C3)C#N
InChI=1SC21H21N3O2Sc1226126112420(25)189341019(18)2321(24)27151785716(1317)1422h3571013H26111215H21H3
MFCD20737887
ZINC000006058195
ZINC6058195
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