Vitas-M small molecule compound
4-({[4-amino-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STL341528
SMILES N#Cc1ccc(cc1)CSc1nnc(n1N)c1cccc(c1)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 C17H15N5S MW 321.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5S/c1-12-3-2-4-15(9-12)16-20-21-17(22(16)19)23-11-14-7-5-13(10-18)6-8-14/h2-9H,11,19H2,1H3InChIKey
PPKAFCTZERXFBP-UHFFFAOYSA-NSynonyms
585551-65-14(((4amino5(3methylphenyl)4H124triazol3yl)sulfanyl)methyl)benzonitrile
4(((4amino5(mtolyl)4H124triazol3yl)thio)methyl)benzonitrile
4((4AMINO5(3METHYLPHENYL)124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
4((4AMINO5(3METHYLPHENYL)124TRIAZOL3YLTHIO)METHYL)BENZENECARBONITRILE
585551651
CC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)C#N
InChI=1SC17H15N5Sc11232415(912)16202117(22(16)19)2311147513(1018)6814h29H1119H21H3
MFCD04028091
ZINC000000531967
ZINC00531967
ZINC531967
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