Vitas-M small molecule compound
N-(butan-2-yl)-2-[3-(3,4-dimethylbenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide
Catalog ID
STL030514
SMILES CCC(NC(=O)Cn1c2ccsc2c(=O)n(c1=O)Cc1ccc(c(c1)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 C21H25N3O3S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3S/c1-5-15(4)22-18(25)12-23-17-8-9-28-19(17)20(26)24(21(23)27)11-16-7-6-13(2)14(3)10-16/h6-10,15H,5,11-12H2,1-4H3,(H,22,25)InChIKey
ZSELDHLCNRFQSM-UHFFFAOYSA-NSynonyms
CCC(C)NC(=O)CN1C2=C(C(=O)N(C1=O)CC3=CC(=C(C=C3)C)C)SC=C2
InChI=1SC21H25N3O3Sc1515(4)2218(25)122317892819(17)20(26)24(21(23)27)11167613(2)14(3)1016h61015H51112H214H3(H2225)
MFCD18190702
N(butan2yl)2(3(34dimethylbenzyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
Nbutan2yl2(3((34dimethylphenyl)methyl)24dioxothieno(32d)pyrimidin1yl)acetamide
ZINC000057426941
ZINC000057426943
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