Vitas-M small molecule compound
1-(1-cyclopropyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STL294475
SMILES COc1ccc(cc1)n1c(SCC(=O)c2cc(n(c2C)C2CC2)C)nnc1c1ccncc1
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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 C25H25N5O2S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2S/c1-16-14-22(17(2)29(16)19-4-5-19)23(31)15-33-25-28-27-24(18-10-12-26-13-11-18)30(25)20-6-8-21(32-3)9-7-20/h6-14,19H,4-5,15H2,1-3H3InChIKey
VPVVAGZRCDZNBU-UHFFFAOYSA-NSynonyms
1(1cyclopropyl25dimethyl1Hpyrrol3yl)2((4(4methoxyphenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)ethanone
1(1CYCLOPROPYL25DIMETHYLPYRROL3YL)2((4(4METHOXYPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ETHANONE
CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NN=C(N3C4=CC=C(C=C4)OC)C5=CC=NC=C5
InChI=1SC25H25N5O2Sc1161422(17(2)29(16)194519)23(31)153325282724(18101226131118)30(25)206821(323)9720h61419H4515H213H3
MFCD08259536
ZINC000009465292
ZINC09465292
ZINC9465292
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