Vitas-M small molecule compound
7-[(6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoate
Catalog ID
STL373009
SMILES [O-]C(=O)CCCCCCNC1c2ccccc2N(S(=O)(=O)c2c1cccc2)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 C21H25N2O4S MW 401.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O4S/c1-23-18-12-7-5-10-16(18)21(22-15-9-3-2-4-14-20(24)25)17-11-6-8-13-19(17)28(23,26)27/h5-8,10-13,21-22H,2-4,9,14-15H2,1H3,(H,24,25)/p-1InChIKey
JMFDJSZIOWLQSP-UHFFFAOYSA-MSynonyms
1263044-66-1(O)C(=O)CCCCCCNC1c2ccccc2N(S(=O)(=O)c2c1cccc2)C
1263044661
7((6methyl55dioxido611dihydrodibenzo(cf)(12)thiazepin11yl)amino)heptanoate
7((6methyl55dioxo11Hbenzo(c)(12)benzothiazepin11yl)amino)heptanoate
CN1C2=CC=CC=C2C(C3=CC=CC=C3S1(=O)=O)NCCCCCCC(=O)(O)
InChI=1SC21H26N2O4Sc1231812751016(18)21(221593241420(24)25)1711681319(17)28(2326)27h5810132122H2491415H21H3(H2425)p1
ZINC000049538510
ZINC000049538511
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