Vitas-M small molecule compound
7-chloro-5-(methylsulfonyl)-N-[4-(propan-2-yl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389625
SMILES O=C(C1CCN(c2c(O1)ccc(c2)Cl)S(=O)(=O)C)Nc1ccc(cc1)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 C20H23ClN2O4S MW 422.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O4S/c1-13(2)14-4-7-16(8-5-14)22-20(24)19-10-11-23(28(3,25)26)17-12-15(21)6-9-18(17)27-19/h4-9,12-13,19H,10-11H2,1-3H3,(H,22,24)InChIKey
GMOIHCXCLOYZJZ-UHFFFAOYSA-NSynonyms
7chloro5(methylsulfonyl)N(4(propan2yl)phenyl)2345tetrahydro15benzoxazepine2carboxamide
7chloro5methylsulfonylN(4propan2ylphenyl)34dihydro2H15benzoxazepine2carboxamide
CC(C)C1=CC=C(C=C1)NC(=O)C2CCN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C
InChI=1SC20H23ClN2O4Sc113(2)144716(8514)2220(24)19101123(28(325)26)171215(21)6918(17)2719h49121319H1011H213H3(H2224)
MFCD13982913
ZINC000038833740
ZINC000038833741
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