Vitas-M small molecule compound
2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Catalog ID
STK553904
SMILES O=C(Nc1ccc(cc1)C(C)C)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)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 C28H29N3O2S2 MW 503.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O2S2/c1-17(2)19-10-12-20(13-11-19)29-24(32)16-34-28-30-26-25(22-6-4-5-7-23(22)35-26)27(33)31(28)21-14-8-18(3)9-15-21/h8-15,17H,4-7,16H2,1-3H3,(H,29,32)InChIKey
OYJVFIKXGBOWAA-UHFFFAOYSA-NSynonyms
752231-77-92((3(4methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(4(propan2yl)phenyl)acetamide
2((3(4methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(4propan2ylphenyl)acetamide
752231779
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=C(C=C4)C(C)C)SC5=C3CCCC5
InChI=1SC28H29N3O2S2c117(2)19101220(131119)2924(32)163428302625(22645723(22)3526)27(33)31(28)2114818(3)91521h81517H4716H213H3(H2932)
MFCD03224319
N(4isopropylphenyl)2((4oxo3(ptolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
ZINC000002259597
ZINC02259597
ZINC2259597
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