Vitas-M small molecule compound
N-(butan-2-yl)-6-chloro-4-[(4-methylphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Catalog ID
STL385564
SMILES CCC(NC(=O)C1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)C)Cl)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 C20H23ClN2O4S MW 422.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O4S/c1-4-14(3)22-20(24)19-12-23(17-11-15(21)7-10-18(17)27-19)28(25,26)16-8-5-13(2)6-9-16/h5-11,14,19H,4,12H2,1-3H3,(H,22,24)InChIKey
FHPMNMWEHAPPJL-UHFFFAOYSA-NSynonyms
CCC(C)NC(=O)C1CN(C2=C(O1)C=CC(=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C
InChI=1SC20H23ClN2O4Sc1414(3)2220(24)191223(171115(21)71018(17)2719)28(2526)168513(2)6916h5111419H412H213H3(H2224)
MFCD27644397
N(butan2yl)6chloro4((4methylphenyl)sulfonyl)34dihydro2H14benzoxazine2carboxamide
Nbutan2yl6chloro4(4methylphenyl)sulfonyl23dihydro14benzoxazine2carboxamide
ZINC000064986090
ZINC000064986093
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