Vitas-M small molecule compound
4-({[5-(morpholin-4-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STK661858
SMILES N#Cc1ccc(cc1)CSc1nnc(n1c1ccccc1)CN1CCOCC1
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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 C21H21N5OS MW 391.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5OS/c22-14-17-6-8-18(9-7-17)16-28-21-24-23-20(15-25-10-12-27-13-11-25)26(21)19-4-2-1-3-5-19/h1-9H,10-13,15-16H2InChIKey
JXOMQFWDACENAW-UHFFFAOYSA-NSynonyms
4(((5(morpholin4ylmethyl)4phenyl4H124triazol3yl)sulfanyl)methyl)benzonitrile
4((5(MORPHOLIN4YLMETHYL)4PHENYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
C1COCCN1CC2=NN=C(N2C3=CC=CC=C3)SCC4=CC=C(C=C4)C#N
InChI=1SC21H21N5OSc2214176818(9717)162821242320(1525101227131125)26(21)194213519h19H10131516H2
MFCD04348550
ZINC000019799161
ZINC19799161
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