Vitas-M small molecule compound
7-tert-butyl-3-(prop-2-en-1-yl)-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK829965
SMILES C=CCn1c(S)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C
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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 C17H22N2OS2 MW 334.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2OS2/c1-5-8-19-15(20)13-11-7-6-10(17(2,3)4)9-12(11)22-14(13)18-16(19)21/h5,10H,1,6-9H2,2-4H3,(H,18,21)InChIKey
ACXZLTAPXZPLMQ-UHFFFAOYSA-NSynonyms
351005-88-4351005884
3allyl7(tertbutyl)2mercapto5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
7tertbutyl3(prop2en1yl)2sulfanyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl3prop2enyl2sulfanylidene5678tetrahydro1H(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=S)N3)CC=C
InChI=1SC17H22N2OS2c1581915(20)13117610(17(23)4)912(11)2214(13)1816(19)21h510H169H224H3(H1821)
MFCD01946719
ZINC000003899590
ZINC000003899591
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