Vitas-M small molecule compound

4-(1H-benzotriazol-1-yl)-5-[(4-bromophenyl)sulfanyl]benzene-1,2-dicarbonitrile

Catalog ID
STK862819
SMILES N#Cc1cc(Sc2ccc(cc2)Br)c(cc1C#N)n1nnc2c1cccc2

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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 C20H10BrN5S MW 432.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H10BrN5S/c21-15-5-7-16(8-6-15)27-20-10-14(12-23)13(11-22)9-19(20)26-18-4-2-1-3-17(18)24-25-26/h1-10H
InChIKey
USRFMXZBQBEIOJ-UHFFFAOYSA-N
Synonyms
492447-28-6
4(1Hbenzo(d)(123)triazol1yl)5((4bromophenyl)thio)phthalonitrile
4(1Hbenzotriazol1yl)5((4bromophenyl)sulfanyl)benzene12dicarbonitrile
4(BENZOTRIAZOL1YL)5(4BROMOPHENYL)SULFANYLBENZENE12DICARBONITRILE
492447286
C1=CC=C2C(=C1)N=NN2C3=C(C=C(C(=C3)C#N)C#N)SC4=CC=C(C=C4)Br
InChI=1SC20H10BrN5Sc21155716(8615)27201014(1223)13(1122)919(20)2618421317(18)242526h110H
MFCD03613836
ZINC000001099242
ZINC01099242
ZINC1099242

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Available files

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