Vitas-M small molecule compound

6-phenyl-3-[(4H-1,2,4-triazol-3-ylsulfanyl)methyl][1,2,4]triazolo[3,4-a]phthalazine

Catalog ID
STK796282
SMILES c1ccc(cc1)c1nn2c(CSc3nnc[nH]3)nnc2c2c1cccc2

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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 C18H13N7S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N7S/c1-2-6-12(7-3-1)16-13-8-4-5-9-14(13)17-22-21-15(25(17)24-16)10-26-18-19-11-20-23-18/h1-9,11H,10H2,(H,19,20,23)
InChIKey
APSROFJYRUGOSH-UHFFFAOYSA-N
Synonyms
896821-35-5
3(((4H124triazol3yl)thio)methyl)6phenyl(124)triazolo(34a)phthalazine
6PHENYL3((1H124TRIAZOL5YLSULFANYL)METHYL)(124)TRIAZOLO(34A)PHTHALAZINE
6phenyl3((4H124triazol3ylsulfanyl)methyl)(124)triazolo(34a)phthalazine
6PHENYL3(1H124TRIAZOL5YLSULFANYLMETHYL)(124)TRIAZOLO(34A)PHTHALAZINE
896821355
C1=CC=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)CSC5=NC=NN5
c1ccc(cc1)c1nn2c(CSc3nnc(nH)3)nnc2c2c1cccc2
InChI=1SC18H13N7Sc12612(731)1613845914(13)17222115(25(17)2416)1026181911202318h1911H10H2(H192023)
MFCD06597409
ZINC000006196078
ZINC06196078
ZINC6196078

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Available files

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