Vitas-M small molecule compound

1,4-di(propan-2-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione

Catalog ID
STL492943
SMILES O=C1CSC(c2c(N1)n([nH]c2=O)C(C)C)C(C)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 C12H19N3O2S MW 269.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H19N3O2S/c1-6(2)10-9-11(13-8(16)5-18-10)15(7(3)4)14-12(9)17/h6-7,10H,5H2,1-4H3,(H,13,16)(H,14,17)
InChIKey
OWRRYUBOEGFTKA-UHFFFAOYSA-N
Synonyms
1401577-14-7
1401577147
14DI(PROPAN2YL)46DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37DIOL
14di(propan2yl)48dihydro1Hpyrazolo(34e)(14)thiazepine37(2H6H)dione
14di(propan2yl)48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
CC(C)C1C2=C(NC(=O)CS1)N(NC2=O)C(C)C
InChI=1SC12H19N3O2Sc16(2)10911(138(16)51810)15(7(3)4)1412(9)17h6710H5H214H3(H1316)(H1417)
MFCD30715458
O=C1CSC(c2c(N1)n((nH)c2=O)C(C)C)C(C)C

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Available files

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