Vitas-M small molecule compound
3-(prop-2-en-1-yl)-11-{[(E)-thiophen-2-ylmethylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL235083
SMILES C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2/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 C20H14N6OS MW 386.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N6OS/c1-2-9-25-12-21-18-16(20(25)27)17-19(24-15-8-4-3-7-14(15)23-17)26(18)22-11-13-6-5-10-28-13/h2-8,10-12H,1,9H2/b22-11+InChIKey
KIYWLUMQNGETOT-SSDVNMTOSA-NSynonyms
860792-80-9(E)3allyl11((thiophen2ylmethylene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(prop2en1yl)11(((E)thiophen2ylmethylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
860792809
C=CCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2N=CC5=CC=CS5
C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1cccs1
InChI=1SC20H14N6OSc1292512211816(20(25)27)1719(2415843714(15)2317)26(18)22111365102813h281012H19H2b2211+
MFCD04162618
ZINC000002407526
ZINC33365769
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