Vitas-M small molecule compound
N-[4-oxo-3-(propan-2-yl)-3,4-dihydroquinazolin-6-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL314394
SMILES O=C(c1ccc2c(c1)OCCCO2)Nc1ccc2c(c1)c(=O)n(cn2)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 C21H21N3O4 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4/c1-13(2)24-12-22-17-6-5-15(11-16(17)21(24)26)23-20(25)14-4-7-18-19(10-14)28-9-3-8-27-18/h4-7,10-13H,3,8-9H2,1-2H3,(H,23,25)InChIKey
SMQKAFDZAGMGJT-UHFFFAOYSA-NSynonyms
1574470-66-81574470668
CC(C)N1C=NC2=C(C1=O)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCCCO4
InChI=1SC21H21N3O4c113(2)241222176515(1116(17)21(24)26)2320(25)14471819(1014)289382718h471013H389H212H3(H2325)
MFCD28030678
N(3isopropyl4oxo34dihydroquinazolin6yl)34dihydro2Hbenzo(b)(14)dioxepine7carboxamide
N(4oxo3(propan2yl)34dihydroquinazolin6yl)34dihydro2H15benzodioxepine7carboxamide
N(4oxo3propan2ylquinazolin6yl)34dihydro2H15benzodioxepine7carboxamide
ZINC000095476285
ZINC95476285
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