Vitas-M small molecule compound

4-[({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzonitrile

Catalog ID
STK596220
SMILES N#Cc1ccc(cc1)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

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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 C23H20N4O2S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O2S/c1-17-4-10-20(11-5-17)29-15-22-25-26-23(27(22)14-21-3-2-12-28-21)30-16-19-8-6-18(13-24)7-9-19/h2-12H,14-16H2,1H3
InChIKey
ZUKURTDUEWURBL-UHFFFAOYSA-N
Synonyms
849017-09-0
4(((4(furan2ylmethyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)methyl)benzonitrile
4(((4(furan2ylmethyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)methyl)benzonitrile
4(((4(FURAN2YLMETHYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)METHYL)BENZONITRILE
4((4(2FURYLMETHYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YLTHIO)METHYL)BENZENECARBONITRILE
4((4(FURAN2YLMETHYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
849017090
CC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CO3)SCC4=CC=C(C=C4)C#N
InChI=1SC23H20N4O2Sc11741020(11517)291522252623(27(22)142132122821)3016198618(1324)7919h212H1416H21H3
MFCD05680766
ZINC000002452010
ZINC02452010
ZINC2452010

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Available files

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