Vitas-M small molecule compound
3,5-dimethyl-N-[(4-methylphenyl)carbamothioyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STL059383
SMILES S=C(NC(=O)C12CC3CC(C2)(CC(C1)(C3)C)C)Nc1ccc(cc1)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 C21H28N2OS MW 356.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2OS/c1-14-4-6-16(7-5-14)22-18(25)23-17(24)21-10-15-8-19(2,12-21)11-20(3,9-15)13-21/h4-7,15H,8-13H2,1-3H3,(H2,22,23,24,25)InChIKey
YFDHSYLOSKBZMO-UHFFFAOYSA-NSynonyms
314031-95-3(1r3R5S7r)35dimethylN(ptolylcarbamothioyl)adamantane1carboxamide
(35DIMETHYLADAMANTANYL)N(((4METHYLPHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
314031953
35DIMETHYLN((4METHYLPHENYL)CARBAMOTHIOYL)ADAMANTANE1CARBOXAMIDE
35dimethylN((4methylphenyl)carbamothioyl)tricyclo(3311~37~)decane1carboxamide
CC1=CC=C(C=C1)NC(=S)NC(=O)C23CC4CC(C2)(CC(C4)(C3)C)C
InChI=1SC21H28N2OSc1144616(7514)2218(25)2317(24)211015819(21221)1120(3915)1321h4715H813H213H3(H222232425)
MFCD01791590
ZINC000018175959
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