Vitas-M small molecule compound
N-(3-{[(1H-1,2,4-triazol-3-ylsulfanyl)acetyl]amino}phenyl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STK280591
SMILES O=C(Nc1cccc(c1)NC(=O)C12CC3CC(C2)CC(C1)C3)CSc1n[nH]cn1
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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 C21H25N5O2S MW 411.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2S/c27-18(11-29-20-22-12-23-26-20)24-16-2-1-3-17(7-16)25-19(28)21-8-13-4-14(9-21)6-15(5-13)10-21/h1-3,7,12-15H,4-6,8-11H2,(H,24,27)(H,25,28)(H,22,23,26)InChIKey
ZSBSTQZVYHYHDY-UHFFFAOYSA-NSynonyms
C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC(=CC=C4)NC(=O)CSC5=NC=NN5
InChI=1SC21H25N5O2Sc2718(1129202212232620)241621317(716)2519(28)21813414(921)615(513)1021h1371215H46811H2(H2427)(H2528)(H222326)
MFCD08718844
N(3(((1H124triazol3ylsulfanyl)acetyl)amino)phenyl)tricyclo(3311~37~)decane1carboxamide
N(3((2(1H124triazol5ylsulfanyl)acetyl)amino)phenyl)adamantane1carboxamide
O=C(Nc1cccc(c1)NC(=O)C12CC3CC(C2)CC(C1)C3)CSc1n(nH)cn1
ZINC000013941980
ZINC13941980
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