Vitas-M small molecule compound
5-chloro-3-methyl-6-[(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)sulfonyl]-1,3-benzoxazol-2(3H)-one
Catalog ID
STK666576
SMILES Cc1ccc2c(c1)c1CCCC3c1n2CCN3S(=O)(=O)c1cc2oc(=O)n(c2cc1Cl)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 C23H22ClN3O4S MW 471.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O4S/c1-13-6-7-17-15(10-13)14-4-3-5-18-22(14)26(17)8-9-27(18)32(29,30)21-12-20-19(11-16(21)24)25(2)23(28)31-20/h6-7,10-12,18H,3-5,8-9H2,1-2H3InChIKey
SCNKZWRREBWRNV-UHFFFAOYSA-NSynonyms
5chloro3methyl6((8methyl123a456hexahydro3Hpyrazino(321jk)carbazol3yl)sulfonyl)13benzoxazol2(3H)one
CC1=CC2=C(C=C1)N3CCN(C4C3=C2CCC4)S(=O)(=O)C5=C(C=C6C(=C5)OC(=O)N6C)Cl
InChI=1SC23H22ClN3O4Sc113671715(1013)144351822(14)26(17)8927(18)32(2930)21122019(1116(21)24)25(2)23(28)3120h67101218H3589H212H3
MFCD10038403
ZINC000015083560
ZINC000015083562
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