Vitas-M small molecule compound

1-(3,4-dimethoxyphenyl)-2-{[5-(furan-2-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STK246260
SMILES COc1cc(ccc1OC)C(=O)CSc1nnc(n1CC(C)C)c1ccco1

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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 C20H23N3O4S MW 401.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O4S/c1-13(2)11-23-19(17-6-5-9-27-17)21-22-20(23)28-12-15(24)14-7-8-16(25-3)18(10-14)26-4/h5-10,13H,11-12H2,1-4H3
InChIKey
BXVVSQYYWHJFGN-UHFFFAOYSA-N
Synonyms

1(34dimethoxyphenyl)2((5(furan2yl)4(2methylpropyl)124triazol3yl)sulfanyl)ethanone
1(34dimethoxyphenyl)2((5(furan2yl)4(2methylpropyl)4H124triazol3yl)sulfanyl)ethanone
1(34DIMETHOXYPHENYL)2(5FURAN2YL4ISOBUTYL4H(124)TRIAZOL3YLSULFANYL)ETHANONE
CC(C)CN1C(=NN=C1SCC(=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CO3
InChI=1SC20H23N3O4Sc113(2)112319(176592717)212220(23)281215(24)147816(253)18(1014)264h51013H1112H214H3
MFCD08683905
ZINC000008389155
ZINC08389155
ZINC8389155

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Available files

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