Vitas-M small molecule compound

2-{[7,7-dimethyl-5-oxo-4-(2-phenylethyl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}-N-methyl-N-phenylacetamide

Catalog ID
STK568475
SMILES CN(c1ccccc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)(C)C

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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 C29H29N5O3S2 MW 559.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O3S2/c1-29(2)16-21-22(17-37-29)39-26-24(21)25(36)33(15-14-19-10-6-4-7-11-19)27-30-31-28(34(26)27)38-18-23(35)32(3)20-12-8-5-9-13-20/h4-13H,14-18H2,1-3H3
InChIKey
GQKGETVEWINIOF-UHFFFAOYSA-N
Synonyms

2((77dimethyl5oxo4(2phenylethyl)4569tetrahydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)NmethylNphenylacetamide
2((77dimethyl5oxo4phenethyl5679tetrahydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)NmethylNphenylacetamide
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)N(C)C5=CC=CC=C5)CCC6=CC=CC=C6)C
InChI=1SC29H29N5O3S2c129(2)162122(173729)392624(21)25(36)33(151419106471119)27303128(34(26)27)381823(35)32(3)20128591320h413H1418H213H3
MFCD03303443
ZINC000001238766
ZINC01238766
ZINC1238766

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Available files

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