Vitas-M small molecule compound
propan-2-yl N-{(Z)-[2-hydroxy-1-(2-methylphenyl)-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}tryptophanate
Catalog ID
STL048169
SMILES CC(OC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1C)O)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 C26H26N4O5 MW 474.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O5/c1-15(2)35-25(33)21(12-17-13-27-20-10-6-5-9-18(17)20)28-14-19-23(31)29-26(34)30(24(19)32)22-11-7-4-8-16(22)3/h4-11,13-15,21,27-28H,12H2,1-3H3,(H,29,31,34)/b19-14-InChIKey
SXUMTPRRAHSENO-RGEXLXHISA-NSynonyms
CC(OC(=O)C(Cc1c(nH)c2c1cccc2)NC=C1C(=O)N=C(N(C1=O)c1ccccc1C)O)C
CC1=CC=CC=C1N2C(=O)C(=CNC(CC3=CNC4=CC=CC=C43)C(=O)OC(C)C)C(=O)NC2=O
InChI=1SC26H26N4O5c115(2)3525(33)21(12171327201065918(17)20)28141923(31)2926(34)30(24(19)32)221174816(22)3h4111315212728H12H213H3(H293134)b1914
MFCD05735929
PROPAN2YL3(1HINDOL3YL)2(((Z)(1(2METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)AMINO)PROPANOATE
propan2ylN((Z)(2hydroxy1(2methylphenyl)46dioxo16dihydropyrimidin5(4H)ylidene)methyl)tryptophanate
ZINC000002209306
ZINC000002209309
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