Vitas-M small molecule compound
2-[(3-methylbenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK400812
SMILES Cc1cccc(c1)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C18H18N2OS2 MW 342.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2OS2/c1-11-5-4-6-12(9-11)10-22-18-19-16(21)15-13-7-2-3-8-14(13)23-17(15)20-18/h4-6,9H,2-3,7-8,10H2,1H3,(H,19,20,21)InChIKey
JOABTCGOQAMQRY-UHFFFAOYSA-NSynonyms
2((3methylbenzyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((3methylphenyl)methylsulfanyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CC1=CC(=CC=C1)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2
Cc1cccc(c1)CSc1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC18H18N2OS2c11154612(911)1022181916(21)1513723814(13)2317(15)2018h469H237810H21H3(H192021)
MFCD02960721
ZINC000001972987
ZINC01972987
ZINC1972987
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