Vitas-M small molecule compound

3-methyl-4-(1-methyl-1H-pyrazol-4-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol

Catalog ID
STK935826
SMILES OC1=Nc2[nH]nc(c2C(SC1)c1cnn(c1)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 C11H13N5OS MW 263.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N5OS/c1-6-9-10(7-3-12-16(2)4-7)18-5-8(17)13-11(9)15-14-6/h3-4,10H,5H2,1-2H3,(H2,13,14,15,17)
InChIKey
JNYZYYAAMCHYHH-UHFFFAOYSA-N
Synonyms
1224128-95-3
1224128953
3methyl4(1methyl1Hpyrazol4yl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
3methyl4(1methylpyrazol4yl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
CC1=C2C(SCC(=O)N=C2NN1)C3=CN(N=C3)C
InChI=1SC11H13N5OSc16910(731216(2)47)1858(17)1311(9)15146h3410H5H212H3(H213141517)
MFCD18178167
OC1=Nc2(nH)nc(c2C(SC1)c1cnn(c1)C)C
ZINC000044901458
ZINC000044901460

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Available files

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