Vitas-M small molecule compound
3-(4-ethylphenyl)-2-({[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STK664419
SMILES CCc1ccc(cc1)n1c(CSc2nnc(n2c2ccccc2)c2ccc(cc2)OC)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 C32H27N5O2S MW 545.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27N5O2S/c1-3-22-13-17-25(18-14-22)36-29(33-28-12-8-7-11-27(28)31(36)38)21-40-32-35-34-30(23-15-19-26(39-2)20-16-23)37(32)24-9-5-4-6-10-24/h4-20H,3,21H2,1-2H3InChIKey
ZEJCTOSRTHTOKJ-UHFFFAOYSA-NSynonyms
3(4ETHYLPHENYL)2(((5(4METHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)METHYL)4(3H)QUINAZOLINONE
3(4ethylphenyl)2(((5(4methoxyphenyl)4phenyl4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
3(4ETHYLPHENYL)2((5(4METHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYLMETHYL)QUINAZOLIN4ONE
CCC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NN=C(N4C5=CC=CC=C5)C6=CC=C(C=C6)OC
InChI=1SC32H27N5O2Sc1322131725(181422)3629(332812871127(28)31(36)38)214032353430(23151926(392)201623)37(32)2495461024h420H321H212H3
MFCD01304908
ZINC000002189255
ZINC02189255
ZINC2189255
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