Vitas-M small molecule compound

2-{5-[(4-bromobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}pyridine

Catalog ID
STL227631
SMILES C=CCn1c(SCc2ccc(cc2)Br)nnc1c1ccccn1

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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 C17H15BrN4S MW 387.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4S/c1-2-11-22-16(15-5-3-4-10-19-15)20-21-17(22)23-12-13-6-8-14(18)9-7-13/h2-10H,1,11-12H2
InChIKey
AMCBQZSKBZKFSF-UHFFFAOYSA-N
Synonyms
578760-93-7
2(4ALLYL5((4BROMOBENZYL)SULFANYL)4H124TRIAZOL3YL)PYRIDINE
2(4ALLYL5((4BROMOBENZYL)THIO)4H124TRIAZOL3YL)PYRIDINE
2(5(((4BROMOPHENYL)METHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)PYRIDINE
2(5((4bromobenzyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)pyridine
2(5((4BROMOPHENYL)METHYLSULFANYL)4PROP2ENYL124TRIAZOL3YL)PYRIDINE
578760937
C=CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)C3=CC=CC=N3
InChI=1SC17H15BrN4Sc12112216(15534101915)202117(22)2312136814(18)9713h210H11112H2
MFCD04025791
ZINC000000703947
ZINC00703947
ZINC703947

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Available files

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