Vitas-M small molecule compound
13-methyl-11-[(4-methylphenyl)sulfonyl]-2-nitro-11,12-dihydro-6H-6,12-epiminodibenzo[b,f][1,5]thiazocine
Catalog ID
STK757605
SMILES Cc1ccc(cc1)S(=O)(=O)N1c2ccccc2C2N(C1c1cc(ccc1S2)[N+](=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 C22H19N3O4S2 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S2/c1-14-7-10-16(11-8-14)31(28,29)24-19-6-4-3-5-17(19)22-23(2)21(24)18-13-15(25(26)27)9-12-20(18)30-22/h3-13,21-22H,1-2H3InChIKey
MACLCUAUEDKUJH-UHFFFAOYSA-NSynonyms
13methyl11((4methylphenyl)sulfonyl)2nitro1112dihydro6H612epiminodibenzo(bf)(15)thiazocine
CC1=CC=C(C=C1)S(=O)(=O)N2C3C4=C(C=CC(=C4)(N+)(=O)(O))SC(N3C)C5=CC=CC=C52
Cc1ccc(cc1)S(=O)(=O)N1c2ccccc2C2N(C1c1cc(ccc1S2)(N+)(=O)(O))C
InChI=1SC22H19N3O4S2c11471016(11814)31(2829)2419643517(19)2223(2)21(24)181315(25(26)27)91220(18)3022h3132122H12H3
MFCD01306221
ZINC000100064895
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