Vitas-M small molecule compound
(6Z)-6-{[2,5-dimethyl-1-(naphthalen-1-yl)-1H-pyrrol-3-yl]methylidene}-5-imino-2-[(2-methylphenoxy)methyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712765
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cc(n(c1C)c1cccc2c1cccc2)C)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 C30H25N5O2S MW 519.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N5O2S/c1-18-9-4-7-14-26(18)37-17-27-33-35-28(31)24(29(36)32-30(35)38-27)16-22-15-19(2)34(20(22)3)25-13-8-11-21-10-5-6-12-23(21)25/h4-16,31H,17H2,1-3H3/b24-16-,31-28-InChIKey
ROALPKJDTNDJED-HOKSGAHSSA-NSynonyms
840472-47-1(6Z)6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylidene)5imino2((2methylphenoxy)methyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylene)5imino2((otolyloxy)methyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
840472471
MFCD04005452
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1cccc2c1cccc2)C)COc1ccccc1C
ZINC000008744325
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