Vitas-M small molecule compound
2-{[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-3-(2-methylphenyl)quinazolin-4(3H)-one
Catalog ID
STK663646
SMILES Cc1ccccc1n1c(CSc2nnc(n2C2CCCCC2)c2ccccc2)nc2c(c1=O)cccc2
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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 C30H29N5OS MW 507.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5OS/c1-21-12-8-11-19-26(21)35-27(31-25-18-10-9-17-24(25)29(35)36)20-37-30-33-32-28(22-13-4-2-5-14-22)34(30)23-15-6-3-7-16-23/h2,4-5,8-14,17-19,23H,3,6-7,15-16,20H2,1H3InChIKey
MSECPBKYDUIFMW-UHFFFAOYSA-NSynonyms
2(((4cyclohexyl5phenyl4H124triazol3yl)sulfanyl)methyl)3(2methylphenyl)quinazolin4(3H)one
2((4CYCLOHEXYL5PHENYL124TRIAZOL3YL)SULFANYLMETHYL)3(2METHYLPHENYL)QUINAZOLIN4ONE
CC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)CSC4=NN=C(N4C5CCCCC5)C6=CC=CC=C6
InChI=1SC30H29N5OSc121128111926(21)3527(3125181091724(25)29(35)36)203730333228(22134251422)34(30)23156371623h245814171923H367151620H21H3
MFCD02853021
ZINC000002190430
ZINC02190430
ZINC2190430
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