Vitas-M small molecule compound
3-(2-chloro-5-nitrophenyl)-3-{[(4-methoxyphenyl)sulfonyl]amino}propanoic acid
Catalog ID
STK683418
SMILES COc1ccc(cc1)S(=O)(=O)NC(c1cc(ccc1Cl)[N+](=O)[O-])CC(=O)O
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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 C16H15ClN2O7S MW 414.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN2O7S/c1-26-11-3-5-12(6-4-11)27(24,25)18-15(9-16(20)21)13-8-10(19(22)23)2-7-14(13)17/h2-8,15,18H,9H2,1H3,(H,20,21)InChIKey
NLEUHVLENFEBCP-UHFFFAOYSA-NSynonyms
(3R)3(2CHLORO5NITROPHENYL)3(((4METHOXYPHENYL)SULFONYL)AMINO)PROPANOICACID
3(2chloro5nitrophenyl)3(((4methoxyphenyl)sulfonyl)amino)propanoicacid
3(2CHLORO5NITROPHENYL)3((4METHOXYPHENYL)SULFONYLAMINO)PROPANOICACID
COC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)O)C2=C(C=CC(=C2)(N+)(=O)(O))Cl
COc1ccc(cc1)S(=O)(=O)NC(c1cc(ccc1Cl)(N+)(=O)(O))CC(=O)O
InChI=1SC16H15ClN2O7Sc126113512(6411)27(2425)1815(916(20)21)13810(19(22)23)2714(13)17h281518H9H21H3(H2021)
MFCD05257787
ZINC000004686993
ZINC000004686994
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