Vitas-M small molecule compound
3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanoic acid
Catalog ID
STL145916
SMILES OC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCC(C3)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 C17H22N2O3S MW 334.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O3S/c1-17(2,3)9-4-5-10-11(8-9)23-16-14(10)15(22)18-12(19-16)6-7-13(20)21/h9H,4-8H2,1-3H3,(H,20,21)(H,18,19,22)InChIKey
CULXUUJRCHADKV-UHFFFAOYSA-NSynonyms
433701-20-33(7tertbutyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)propanoicacid
3(7tertbutyl4oxo5678tetrahydro3H(1)benzothiolo(23d)pyrimidin2yl)propanoicacid
433701203
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(=N3)CCC(=O)O
InChI=1SC17H22N2O3Sc117(23)9451011(89)231614(10)15(22)1812(1916)6713(20)21h9H48H213H3(H2021)(H181922)
MFCD03146745
OC(=O)CCc1nc2sc3c(c2c(=O)(nH)1)CCC(C3)C(C)(C)C
ZINC000012381411
ZINC000012381412
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