Vitas-M small molecule compound
N-[(E)-(4,6-dioxo-1-phenyl-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]tryptophan
Catalog ID
STK615985
SMILES OC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1)S
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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 C22H18N4O4S MW 434.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O4S/c27-19-16(20(28)26(22(31)25-19)14-6-2-1-3-7-14)12-24-18(21(29)30)10-13-11-23-17-9-5-4-8-15(13)17/h1-9,11-12,18,23-24H,10H2,(H,29,30)(H,25,27,31)/b16-12+InChIKey
FVDFGMIRFQVUEI-FOWTUZBSSA-NSynonyms
2(((E)(46dioxo1phenyl2sulfanylidene13diazinan5ylidene)methyl)amino)3(1Hindol3yl)propanoicacid
C1=CC=C(C=C1)N2C(=O)C(=CNC(CC3=CNC4=CC=CC=C43)C(=O)O)C(=O)NC2=S
InChI=1SC22H18N4O4Sc271916(20(28)26(22(31)2519)146213714)122418(21(29)30)1013112317954815(13)17h191112182324H10H2(H2930)(H252731)b1612+
MFCD08733007
N((E)(46dioxo1phenyl2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)tryptophan
OC(=O)C(Cc1c(nH)c2c1cccc2)NC=C1C(=O)N=C(N(C1=O)c1ccccc1)S
ZINC000020573380
ZINC000020573382
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