Vitas-M small molecule compound

(6E)-6-{[2,5-dimethyl-1-(naphthalen-2-yl)-1H-pyrrol-3-yl]methylidene}-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Catalog ID
STK556371
SMILES O=C(N1CCCC1)Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccc4c(c3)cccc4)C)/C2=N)s1

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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 C28H26N6O2S MW 510.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N6O2S/c1-17-13-21(18(2)33(17)22-10-9-19-7-3-4-8-20(19)14-22)15-23-26(29)34-28(30-27(23)36)37-24(31-34)16-25(35)32-11-5-6-12-32/h3-4,7-10,13-15,29H,5-6,11-12,16H2,1-2H3/b23-15+,29-26-
InChIKey
KXOGREBYHKYSPM-IQUJYTIYSA-N
Synonyms
573694-34-5
(6E)6((25dimethyl1(naphthalen2yl)1Hpyrrol3yl)methylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(naphthalen2yl)1Hpyrrol3yl)methylene)5imino2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
573694345
MFCD04017532
O=C(N1CCCC1)Cc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccc4c(c3)cccc4)C)C2=N)s1
ZINC000009459784

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Available files

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