Vitas-M small molecule compound
7-tert-butyl-2-(3-hydroxyphenyl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK382123
SMILES Oc1cccc(c1)C1NC(=O)c2c(N1)sc1c2CCC(C1)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 C20H24N2O2S MW 356.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O2S/c1-20(2,3)12-7-8-14-15(10-12)25-19-16(14)18(24)21-17(22-19)11-5-4-6-13(23)9-11/h4-6,9,12,17,22-23H,7-8,10H2,1-3H3,(H,21,24)InChIKey
KLPBWGQWYSJOKJ-UHFFFAOYSA-NSynonyms
7tertbutyl2(3hydroxyphenyl)235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
7tertbutyl2(3hydroxyphenyl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=CC=C4)O
InChI=1SC20H24N2O2Sc120(23)12781415(1012)251916(14)18(24)2117(2219)1154613(23)911h46912172223H7810H213H3(H2124)
MFCD02915435
ZINC000005838549
ZINC000005838950
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