Vitas-M small molecule compound

2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]acetamide

Catalog ID
STL251998
SMILES O=C(Nc1[nH]nc(n1)C(C)C)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1

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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 C20H24N6O3 MW 396.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N6O3/c1-12(2)18-23-20(25-24-18)22-17(27)11-29-13-7-8-15-14(10-13)19(28)26-9-5-3-4-6-16(26)21-15/h7-8,10,12H,3-6,9,11H2,1-2H3,(H2,22,23,24,25,27)
InChIKey
NUZLZKVLUHKBMS-UHFFFAOYSA-N
Synonyms
1380579-04-3
1380579043
2((12oxo67891012hexahydroazepino(21b)quinazolin2yl)oxy)N(3(propan2yl)1H124triazol5yl)acetamide
2((12oxo78910tetrahydro6Hazepino(21b)quinazolin2yl)oxy)N(5propan2yl1H124triazol3yl)acetamide
CC(C)C1=NC(=NN1)NC(=O)COC2=CC3=C(C=C2)N=C4CCCCCN4C3=O
InChI=1SC20H24N6O3c112(2)182320(252418)2217(27)112913781514(1013)19(28)269534616(26)2115h781012H36911H212H3(H22223242527)
MFCD24852831
N(5isopropyl1H124triazol3yl)2((12oxo67891012hexahydroazepino(21b)quinazolin2yl)oxy)acetamide
O=C(Nc1(nH)nc(n1)C(C)C)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1
O=C(Nc1n(nH)c(n1)C(C)C)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1
ZINC000079494463
ZINC79494463

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Available files

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