Vitas-M small molecule compound
7-chloro-5-(methylsulfonyl)-N-(2,4,6-trimethylphenyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389806
SMILES Clc1ccc2c(c1)N(CCC(O2)C(=O)Nc1c(C)cc(cc1C)C)S(=O)(=O)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/c1-12-9-13(2)19(14(3)10-12)22-20(24)18-7-8-23(28(4,25)26)16-11-15(21)5-6-17(16)27-18/h5-6,9-11,18H,7-8H2,1-4H3,(H,22,24)InChIKey
RHUIEUKWBHDKRT-UHFFFAOYSA-NSynonyms
7chloro5(methylsulfonyl)N(246trimethylphenyl)2345tetrahydro15benzoxazepine2carboxamide
7chloro5methylsulfonylN(246trimethylphenyl)34dihydro2H15benzoxazepine2carboxamide
CC1=CC(=C(C(=C1)C)NC(=O)C2CCN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C)C
InChI=1SC20H23ClN2O4Sc112913(2)19(14(3)1012)2220(24)187823(28(425)26)161115(21)5617(16)2718h5691118H78H214H3(H2224)
MFCD13987305
ZINC000044786890
ZINC000044786892
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