Vitas-M small molecule compound
7-chloro-N-(2-methoxy-5-methylphenyl)-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389740
SMILES COc1ccc(cc1NC(=O)C1CCN(c2c(O1)ccc(c2)Cl)S(=O)(=O)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 C19H21ClN2O5S MW 424.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN2O5S/c1-12-4-6-16(26-2)14(10-12)21-19(23)18-8-9-22(28(3,24)25)15-11-13(20)5-7-17(15)27-18/h4-7,10-11,18H,8-9H2,1-3H3,(H,21,23)InChIKey
BPKIQCQZKIOALX-UHFFFAOYSA-NSynonyms
7chloroN(2methoxy5methylphenyl)5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
7chloroN(2methoxy5methylphenyl)5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
CC1=CC(=C(C=C1)OC)NC(=O)C2CCN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C
InChI=1SC19H21ClN2O5Sc1124616(262)14(1012)2119(23)188922(28(324)25)151113(20)5717(15)2718h47101118H89H213H3(H2123)
MFCD13985105
ZINC000038849482
ZINC000038849483
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