Vitas-M small molecule compound

6-tert-butyl-4-(phenylsulfonyl)-N-[4-(propan-2-yl)phenyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide

Catalog ID
STL385353
SMILES CC(c1ccc(cc1)NC(=O)C1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccccc1)C(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 C28H32N2O4S MW 492.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O4S/c1-19(2)20-11-14-22(15-12-20)29-27(31)26-18-30(35(32,33)23-9-7-6-8-10-23)24-17-21(28(3,4)5)13-16-25(24)34-26/h6-17,19,26H,18H2,1-5H3,(H,29,31)
InChIKey
KCWURKMJOCHGFQ-UHFFFAOYSA-N
Synonyms

4(benzenesulfonyl)6tertbutylN(4propan2ylphenyl)23dihydro14benzoxazine2carboxamide
6tertbutyl4(phenylsulfonyl)N(4(propan2yl)phenyl)34dihydro2H14benzoxazine2carboxamide
CC(C)C1=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=1SC28H32N2O4Sc119(2)20111422(151220)2927(31)261830(35(3233)2397681023)241721(28(34)5)131625(24)3426h6171926H18H215H3(H2931)
MFCD27217380
ZINC000064985501
ZINC000064985502

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Available files

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