Vitas-M small molecule compound
furan-2-yl[10-methoxy-2-methyl-3-(4-methylphenyl)-4-thioxo-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl]methanone
Catalog ID
STL141962
SMILES COc1cccc2c1OC1(C)CC2N(C(=S)N1c1ccc(cc1)C)C(=O)c1ccco1
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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 C24H22N2O4S MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O4S/c1-15-9-11-16(12-10-15)26-23(31)25(22(27)20-8-5-13-29-20)18-14-24(26,2)30-21-17(18)6-4-7-19(21)28-3/h4-13,18H,14H2,1-3H3InChIKey
NCJMCEZJCCPVTR-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N2C(=S)N(C3CC2(OC4=C3C=CC=C4OC)C)C(=O)C5=CC=CO5
furan2yl(10methoxy2methyl3(4methylphenyl)4thioxo34dihydro2H26methano135benzoxadiazocin5(6H)yl)methanone
InChI=1SC24H22N2O4Sc11591116(121015)2623(31)25(22(27)2085132920)181424(262)302117(18)64719(21)283h41318H14H213H3
MFCD20735689
ZINC000102906709
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