Vitas-M small molecule compound
2-amino-7,7-dimethyl-4-(4-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}thiophen-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK780304
SMILES N#CC1=C(N)OC2=C(C1c1scc(c1)CSc1nnnn1C)C(=O)CC(C2)(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 C19H20N6O2S2 MW 428.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O2S2/c1-19(2)5-12(26)16-13(6-19)27-17(21)11(7-20)15(16)14-4-10(8-28-14)9-29-18-22-23-24-25(18)3/h4,8,15H,5-6,9,21H2,1-3H3InChIKey
XPTHGAQXLXIICR-UHFFFAOYSA-NSynonyms
2amino77dimethyl4(4(((1methyl1Htetrazol5yl)sulfanyl)methyl)thiophen2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO77DIMETHYL4(4((1METHYLTETRAZOL5YL)SULFANYLMETHYL)THIOPHEN2YL)5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=CS3)CSC4=NN=NN4C)C(=O)C1)C
InChI=1SC19H20N6O2S2c119(2)512(26)1613(619)2717(21)11(720)15(16)14410(82814)9291822232425(18)3h4815H56921H213H3
MFCD05860105
ZINC000012402361
ZINC000012402362
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