Vitas-M small molecule compound
methyl 3-({[5-(2-nitrophenyl)furan-2-yl]carbonyl}amino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Catalog ID
STK188868
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1ccc(o1)c1ccccc1[N+](=O)[O-])N1CCN(CC1)C(=O)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 C30H26N4O7 MW 554.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O7/c1-40-30(37)21-11-12-25(32-15-17-33(18-16-32)29(36)20-7-3-2-4-8-20)23(19-21)31-28(35)27-14-13-26(41-27)22-9-5-6-10-24(22)34(38)39/h2-14,19H,15-18H2,1H3,(H,31,35)InChIKey
RTZOXDPVLXFBFN-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O)
COC(=O)c1ccc(c(c1)NC(=O)c1ccc(o1)c1ccccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccccc1
InChI=1SC30H26N4O7c14030(37)21111225(32151733(181632)29(36)207324820)23(1921)3128(35)27141326(4127)229561024(22)34(38)39h21419H1518H21H3(H3135)
METHYL3(((5(2NITROPHENYL)FURAN2YL)CARBONYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
methyl4(4benzoylpiperazin1yl)3((5(2nitrophenyl)furan2carbonyl)amino)benzoate
MFCD06664962
ZINC000100405030
ZINC100405030
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