Vitas-M small molecule compound

3-(2-phenylethyl)-11-{[(E)-thiophen-2-ylmethylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STK556151
SMILES O=c1n(CCc2ccccc2)cnc2c1c1nc3ccccc3nc1n2/N=C/c1cccs1

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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 C25H18N6OS MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N6OS/c32-25-21-22-24(29-20-11-5-4-10-19(20)28-22)31(27-15-18-9-6-14-33-18)23(21)26-16-30(25)13-12-17-7-2-1-3-8-17/h1-11,14-16H,12-13H2/b27-15+
InChIKey
FXPJKWNTFRVYOH-JFLMPSFJSA-N
Synonyms
861820-73-7
(E)3phenethyl11((thiophen2ylmethylene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(2phenylethyl)11(((E)thiophen2ylmethylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
861820737
C1=CC=C(C=C1)CCN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CC=CS6
InChI=1SC25H18N6OSc3225212224(292011541019(20)2822)31(27151896143318)23(21)261630(25)1312177213817h1111416H1213H2b2715+
MFCD04016099
O=c1n(CCc2ccccc2)cnc2c1c1nc3ccccc3nc1n2N=Cc1cccs1
ZINC000002448007
ZINC33372718

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Available files

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