Vitas-M small molecule compound
2-[(2,5-dimethylbenzyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL341497
SMILES C=CCn1c(SCc2cc(C)ccc2C)nc2c(c1=O)c1CCCCc1s2
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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 C22H24N2OS2 MW 396.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2OS2/c1-4-11-24-21(25)19-17-7-5-6-8-18(17)27-20(19)23-22(24)26-13-16-12-14(2)9-10-15(16)3/h4,9-10,12H,1,5-8,11,13H2,2-3H3InChIKey
LJGLFVRPHVDOCN-UHFFFAOYSA-NSynonyms
577699-69-52((25dimethylbenzyl)sulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((25dimethylphenyl)methylsulfanyl)3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3allyl2((25dimethylbenzyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
577699695
CC1=CC(=C(C=C1)C)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C
InChI=1SC22H24N2OS2c14112421(25)1917756818(17)2720(19)2322(24)2613161214(2)91015(16)3h491012H1581113H223H3
MFCD04027866
ZINC000002382397
ZINC02382397
ZINC2382397
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