Vitas-M small molecule compound

N-cyclopentyl-2-(3-{(E)-[1-(4-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)acetamide

Catalog ID
STL368192
SMILES Fc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)CC(=O)NC2CCCC2)/C1=O

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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 C26H23FN4O3S MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FN4O3S/c27-17-9-11-19(12-10-17)31-25(34)21(24(33)29-26(31)35)13-16-14-30(22-8-4-3-7-20(16)22)15-23(32)28-18-5-1-2-6-18/h3-4,7-14,18H,1-2,5-6,15H2,(H,28,32)(H,29,33,35)/b21-13+
InChIKey
DNFDAAGFNPFZJS-FYJGNVAPSA-N
Synonyms

C1CCC(C1)NC(=O)CN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=S)N(C4=O)C5=CC=C(C=C5)F
Fc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2cn(c3c2cccc3)CC(=O)NC2CCCC2)C1=O
InChI=1SC26H23FN4O3Sc271791119(121017)3125(34)21(24(33)2926(31)35)13161430(22843720(16)22)1523(32)2818512618h3471418H125615H2(H2832)(H293335)b2113+
MFCD03784628
NCYCLOPENTYL2(3((E)(1(4FLUOROPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)INDOL1YL)ACETAMIDE
Ncyclopentyl2(3((E)(1(4fluorophenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)1Hindol1yl)acetamide
ZINC000002126759
ZINC2126759

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Available files

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