Vitas-M small molecule compound
6-tert-butyl-N-(4-methylphenyl)-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Catalog ID
STL385346
SMILES O=C(C1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccccc1)C(C)(C)C)Nc1ccc(cc1)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 C26H28N2O4S MW 464.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O4S/c1-18-10-13-20(14-11-18)27-25(29)24-17-28(33(30,31)21-8-6-5-7-9-21)22-16-19(26(2,3)4)12-15-23(22)32-24/h5-16,24H,17H2,1-4H3,(H,27,29)InChIKey
AJVRCRRFHRTYAW-UHFFFAOYSA-NSynonyms
4(benzenesulfonyl)6tertbutylN(4methylphenyl)23dihydro14benzoxazine2carboxamide
6tertbutylN(4methylphenyl)4(phenylsulfonyl)34dihydro2H14benzoxazine2carboxamide
CC1=CC=C(C=C1)NC(=O)C2CN(C3=C(O2)C=CC(=C3)C(C)(C)C)S(=O)(=O)C4=CC=CC=C4
InChI=1SC26H28N2O4Sc118101320(141118)2725(29)241728(33(3031)218657921)221619(26(23)4)121523(22)3224h51624H17H214H3(H2729)
MFCD27217373
ZINC000064985476
ZINC000064985478
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