Vitas-M small molecule compound
7-methoxy-3-{[(E)-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]phenyl}methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Catalog ID
STL247806
SMILES COc1ccc(cc1CSc1ccccn1)/C=N/n1cnc2c(c1=O)[nH]c1c2ccc(c1)OC
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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 C25H21N5O3S MW 471.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O3S/c1-32-18-7-8-19-20(12-18)29-24-23(19)27-15-30(25(24)31)28-13-16-6-9-21(33-2)17(11-16)14-34-22-5-3-4-10-26-22/h3-13,15,29H,14H2,1-2H3/b28-13+InChIKey
YUPVDUHHHLNBBG-XODNFHPESA-NSynonyms
847244-37-5(E)7methoxy3((4methoxy3((pyridin2ylthio)methyl)benzylidene)amino)3Hpyrimido(54b)indol4(5H)one
7methoxy3(((E)(4methoxy3((pyridin2ylsulfanyl)methyl)phenyl)methylidene)amino)35dihydro4Hpyrimido(54b)indol4one
7methoxy3((E)(4methoxy3(pyridin2ylsulfanylmethyl)phenyl)methylideneamino)5Hpyrimido(54b)indol4one
847244375
COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C=N3)N=CC4=CC(=C(C=C4)OC)CSC5=CC=CC=N5
COc1ccc(cc1CSc1ccccn1)C=Nn1cnc2c(c1=O)(nH)c1c2ccc(c1)OC
InChI=1SC25H21N5O3Sc13218781920(1218)292423(19)271530(25(24)31)2813166921(332)17(1116)143422534102622h3131529H14H212H3b2813+
MFCD04174391
ZINC000009282694
ZINC33370481
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