Vitas-M small molecule compound
(6Z)-5-imino-2-[(2-methylphenoxy)methyl]-6-{[1-(naphthalen-1-ylmethyl)-1H-indol-3-yl]methylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK554526
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cn(c2c1cccc2)Cc1cccc2c1cccc2)COc1ccccc1C
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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 C33H25N5O2S MW 555.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H25N5O2S/c1-21-9-2-7-16-29(21)40-20-30-36-38-31(34)27(32(39)35-33(38)41-30)17-24-19-37(28-15-6-5-14-26(24)28)18-23-12-8-11-22-10-3-4-13-25(22)23/h2-17,19,34H,18,20H2,1H3/b27-17-,34-31-InChIKey
RHKUEVDLZKZDEF-BHVNOFQDSA-NSynonyms
(6Z)5imino2((2methylphenoxy)methyl)6((1(naphthalen1ylmethyl)1Hindol3yl)methylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6((1(naphthalen1ylmethyl)1Hindol3yl)methylene)2((otolyloxy)methyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
MFCD04005874
O=C1N=c2sc(nn2C(=N)C1=Cc1cn(c2c1cccc2)Cc1cccc2c1cccc2)COc1ccccc1C
ZINC000097964921
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