Vitas-M small molecule compound
N-(8-tert-butyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)-3,4-dimethoxybenzamide
Catalog ID
STL137446
SMILES COc1cc(ccc1OC)C(=O)Nc1cnc2n(c1=O)c1CCC(Cc1s2)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 C23H27N3O4S MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O4S/c1-23(2,3)14-7-8-16-19(11-14)31-22-24-12-15(21(28)26(16)22)25-20(27)13-6-9-17(29-4)18(10-13)30-5/h6,9-10,12,14H,7-8,11H2,1-5H3,(H,25,27)InChIKey
DPBQYDSJUQPKPD-UHFFFAOYSA-NSynonyms
CC(C)(C)C1CCC2=C(C1)SC3=NC=C(C(=O)N23)NC(=O)C4=CC(=C(C=C4)OC)OC
InChI=1SC23H27N3O4Sc123(23)14781619(1114)3122241215(21(28)26(16)22)2520(27)136917(294)18(1013)305h69101214H7811H215H3(H2527)
MFCD09599190
N(8tertbutyl4oxo6789tetrahydro4Hpyrimido(21b)(13)benzothiazol3yl)34dimethoxybenzamide
N(8tertbutyl4oxo6789tetrahydropyrimido(21b)(13)benzothiazol3yl)34dimethoxybenzamide
ZINC000009029113
ZINC000009029115
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