Vitas-M small molecule compound

1-benzyl-6-chloro-3-{[4-ethyl-5-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one

Catalog ID
STK207081
SMILES CCn1c(nnc1CC(C)C)Sc1c(c2ccccc2)c2cc(Cl)ccc2n(c1=O)Cc1ccccc1

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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 C30H29ClN4OS MW 529.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29ClN4OS/c1-4-34-26(17-20(2)3)32-33-30(34)37-28-27(22-13-9-6-10-14-22)24-18-23(31)15-16-25(24)35(29(28)36)19-21-11-7-5-8-12-21/h5-16,18,20H,4,17,19H2,1-3H3
InChIKey
SQSIOQACJVVTDZ-UHFFFAOYSA-N
Synonyms
1benzyl6chloro3((4ethyl5(2methylpropyl)124triazol3yl)sulfanyl)4phenylquinolin2one
1benzyl6chloro3((4ethyl5(2methylpropyl)4H124triazol3yl)sulfanyl)4phenylquinolin2(1H)one
6CHLORO3(4ETHYL5(2METHYLPROPYL)(124TRIAZOL3YLTHIO))4PHENYL1BENZYLHYDROQUINOLIN2ONE
CCN1C(=NN=C1SC2=C(C3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4)C5=CC=CC=C5)CC(C)C
Registry IDs
MFCD06191911
ZINC000009972215
ZINC09972215
ZINC9972215

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Available files

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