Vitas-M small molecule compound
N-{2-[(butylamino)(phenyl)methyl]-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-yl}-4-nitrobenzamide
Catalog ID
STK689951
SMILES COCc1cc(C)nc2c1c(NC(=O)c1ccc(cc1)[N+](=O)[O-])c(s2)C(c1ccccc1)NCCCC
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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 C28H30N4O4S MW 518.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O4S/c1-4-5-15-29-24(19-9-7-6-8-10-19)26-25(23-21(17-36-3)16-18(2)30-28(23)37-26)31-27(33)20-11-13-22(14-12-20)32(34)35/h6-14,16,24,29H,4-5,15,17H2,1-3H3,(H,31,33)InChIKey
JGRPMBJROBKLTM-UHFFFAOYSA-NSynonyms
CCCCNC(C1=CC=CC=C1)C2=C(C3=C(S2)N=C(C=C3COC)C)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
COCc1cc(C)nc2c1c(NC(=O)c1ccc(cc1)(N+)(=O)(O))c(s2)C(c1ccccc1)NCCCC
InChI=1SC28H30N4O4Sc145152924(1997681019)2625(2321(17363)1618(2)3028(23)3726)3127(33)20111322(141220)32(34)35h614162429H451517H213H3(H3133)
MFCD09062920
N(2((butylamino)(phenyl)methyl)4(methoxymethyl)6methylthieno(23b)pyridin3yl)4nitrobenzamide
N(2(butylamino(phenyl)methyl)4(methoxymethyl)6methylthieno(23b)pyridin3yl)4nitrobenzamide
ZINC000012420156
ZINC000012420158
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