Vitas-M small molecule compound
3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-N,N-dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Catalog ID
STK983561
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)N(C)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 C18H17N3O8S MW 435.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O8S/c1-19(2)30(26,27)12-5-6-13-17(9-12)29-18(23)20(13)10-15(22)11-4-7-16(28-3)14(8-11)21(24)25/h4-9H,10H2,1-3H3InChIKey
AQTMLGAOMQCVGA-UHFFFAOYSA-NSynonyms
3(2(4methoxy3nitrophenyl)2oxoethyl)NNdimethyl2oxo13benzoxazole6sulfonamide
3(2(4methoxy3nitrophenyl)2oxoethyl)NNdimethyl2oxo23dihydro13benzoxazole6sulfonamide
CN(C)S(=O)(=O)C1=CC2=C(C=C1)N(C(=O)O2)CC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)N(C)C
InChI=1SC18H17N3O8Sc119(2)30(2627)12561317(912)2918(23)20(13)1015(22)114716(283)14(811)21(24)25h49H10H213H3
MFCD08847483
ZINC000011689646
ZINC11689646
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