Vitas-M small molecule compound
2-[5-(3-chloro-2-methylphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl benzenesulfonate
Catalog ID
STL049123
SMILES O=C1C2C(c3ccccc3OS(=O)(=O)c3ccccc3)N(OC2C(=O)N1c1cccc(c1C)Cl)c1ccccc1
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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 C30H23ClN2O6S MW 575.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23ClN2O6S/c1-19-23(31)16-10-17-24(19)32-29(34)26-27(33(38-28(26)30(32)35)20-11-4-2-5-12-20)22-15-8-9-18-25(22)39-40(36,37)21-13-6-3-7-14-21/h2-18,26-28H,1H3InChIKey
LRQBUERZYYWJBX-UHFFFAOYSA-NSynonyms
(2(5(3CHLORO2METHYLPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)PHENYL)BENZENESULFONATE
2(5(3chloro2methylphenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenylbenzenesulfonate
2(5(3chloro2methylphenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)phenylbenzenesulfonate
CC1=C(C=CC=C1Cl)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=CC=C5OS(=O)(=O)C6=CC=CC=C6
InChI=1SC30H23ClN2O6Sc11923(31)16101724(19)3229(34)2627(33(3828(26)30(32)35)20114251220)2215891825(22)3940(3637)21136371421h2182628H1H3
MFCD05731537
ZINC000002604738
ZINC000245246436
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