Vitas-M small molecule compound
9-(4-methylphenyl)-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one
Catalog ID
STL389453
SMILES Cc1ccc(cc1)C1Nc2nonc2NC2=C1C(=O)CCC2
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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 C16H16N4O2 MW 296.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2/c1-9-5-7-10(8-6-9)14-13-11(3-2-4-12(13)21)17-15-16(18-14)20-22-19-15/h5-8,14H,2-4H2,1H3,(H,17,19)(H,18,20)InChIKey
JERGPKHOQLBISF-UHFFFAOYSA-NSynonyms
5(4methylphenyl)135789hexahydro(125)oxadiazolo(34b)(14)benzodiazepin6one
9(4methylphenyl)67910tetrahydro4H(125)oxadiazolo(34b)(14)benzodiazepin8(5H)one
CC1=CC=C(C=C1)C2C3=C(CCCC3=O)N=C4C(=N2)NON4
InChI=1SC16H16N4O2c195710(869)141311(32412(13)21)171516(1814)20221915h5814H24H21H3(H1719)(H1820)
MFCD26119555
ZINC000072461827
ZINC000072461828
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