Vitas-M small molecule compound
4-[2-({4-amino-6-[(4-methylphenyl)amino]-5-nitropyrimidin-2-yl}amino)ethyl]benzenesulfonamide
Catalog ID
STL411694
SMILES Cc1ccc(cc1)Nc1nc(NCCc2ccc(cc2)S(=O)(=O)N)nc(c1[N+](=O)[O-])N
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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 C19H21N7O4S MW 443.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N7O4S/c1-12-2-6-14(7-3-12)23-18-16(26(27)28)17(20)24-19(25-18)22-11-10-13-4-8-15(9-5-13)31(21,29)30/h2-9H,10-11H2,1H3,(H2,21,29,30)(H4,20,22,23,24,25)InChIKey
BMEWZMWUBUSBFI-UHFFFAOYSA-NSynonyms
4(2((4amino6((4methylphenyl)amino)5nitropyrimidin2yl)amino)ethyl)benzenesulfonamide
4(2((4amino6(4methylanilino)5nitropyrimidin2yl)amino)ethyl)benzenesulfonamide
CC1=CC=C(C=C1)NC2=NC(=NC(=C2(N+)(=O)(O))N)NCCC3=CC=C(C=C3)S(=O)(=O)N
Cc1ccc(cc1)Nc1nc(NCCc2ccc(cc2)S(=O)(=O)N)nc(c1(N+)(=O)(O))N
InChI=1SC19H21N7O4Sc1122614(7312)231816(26(27)28)17(20)2419(2518)221110134815(9513)31(2129)30h29H1011H21H3(H2212930)(H42022232425)
MFCD26101993
ZINC000035681953
ZINC35681953
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