Vitas-M small molecule compound

N-[9-(benzylsulfanyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]ethane-1,2-diamine

Catalog ID
STL227046
SMILES NCCNc1nc(SCc2ccccc2)nc2c1sc1c2c2CCCc2c(n1)c1ccccc1

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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 C27H25N5S2 MW 483.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5S2/c28-14-15-29-25-24-23(31-27(32-25)33-16-17-8-3-1-4-9-17)21-19-12-7-13-20(19)22(30-26(21)34-24)18-10-5-2-6-11-18/h1-6,8-11H,7,12-16,28H2,(H,29,31,32)
InChIKey
RMHZXFRZGKTRAE-UHFFFAOYSA-N
Synonyms
844836-83-5
844836835
C1CC2=C3C4=C(C(=NC(=N4)SCC5=CC=CC=C5)NCCN)SC3=NC(=C2C1)C6=CC=CC=C6
InChI=1SC27H25N5S2c28141529252423(3127(3225)3316178314917)21191271320(19)22(3026(21)3424)18105261118h16811H7121628H2(H293132)
MFCD04164172
N(9(benzylsulfanyl)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)ethane12diamine
N1(9(benzylthio)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)ethane12diamine
ZINC000002410771
ZINC2410771

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Available files

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