Vitas-M small molecule compound
6-tert-butyl-N-(2-methoxybenzyl)-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Catalog ID
STL385366
SMILES COc1ccccc1CNC(=O)C1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccccc1)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 C27H30N2O5S MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O5S/c1-27(2,3)20-14-15-24-22(16-20)29(35(31,32)21-11-6-5-7-12-21)18-25(34-24)26(30)28-17-19-10-8-9-13-23(19)33-4/h5-16,25H,17-18H2,1-4H3,(H,28,30)InChIKey
QKBXSGOBPZTFDV-UHFFFAOYSA-NSynonyms
4(benzenesulfonyl)6tertbutylN((2methoxyphenyl)methyl)23dihydro14benzoxazine2carboxamide
6tertbutylN(2methoxybenzyl)4(phenylsulfonyl)34dihydro2H14benzoxazine2carboxamide
CC(C)(C)C1=CC2=C(C=C1)OC(CN2S(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CC=CC=C4OC
InChI=1SC27H30N2O5Sc127(23)2014152422(1620)29(35(3132)21116571221)1825(3424)26(30)28171910891323(19)334h51625H1718H214H3(H2830)
MFCD27217393
ZINC000064985549
ZINC000064985550
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