Vitas-M small molecule compound

2-[(2-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl)acetyl]-N-phenylhydrazinecarbothioamide

Catalog ID
STK097695
SMILES O=C(CC1C(C)(O)CCC2C1(C)CCCC2(C)C)NNC(=S)Nc1ccccc1

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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 C23H35N3O2S MW 417.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H35N3O2S/c1-21(2)12-8-13-22(3)17(21)11-14-23(4,28)18(22)15-19(27)25-26-20(29)24-16-9-6-5-7-10-16/h5-7,9-10,17-18,28H,8,11-15H2,1-4H3,(H,25,27)(H2,24,26,29)
InChIKey
GRHLQFYSWBUOFY-UHFFFAOYSA-N
Synonyms

1((2(2hydroxy2558atetramethyl344a678hexahydro1Hnaphthalen1yl)acetyl)amino)3phenylthiourea
2((2hydroxy2558atetramethyldecahydronaphthalen1yl)acetyl)Nphenylhydrazinecarbothioamide
CC1(CCCC2(C1CCC(C2CC(=O)NNC(=S)NC3=CC=CC=C3)(C)O)C)C
InChI=1SC23H35N3O2Sc121(2)1281322(3)17(21)111423(428)18(22)1519(27)252620(29)241696571016h57910171828H81115H214H3(H2527)(H2242629)
MFCD02029809
O=C(CC1C(C)(O)CCC2C1(C)CCCC2(C)C)NNC(=S)Nc1ccccc1
STK097695
ZINC000004663688
ZINC000245253538

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Available files

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