Vitas-M small molecule compound

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

Catalog ID
STL493091
SMILES O=C1CSC(c2c(N1)n([nH]c2=O)C(C)C)c1cccc2c1nccc2

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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 C18H18N4O2S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O2S/c1-10(2)22-17-14(18(24)21-22)16(25-9-13(23)20-17)12-7-3-5-11-6-4-8-19-15(11)12/h3-8,10,16H,9H2,1-2H3,(H,20,23)(H,21,24)
InChIKey
QRIQZLZKHDYURI-UHFFFAOYSA-N
Synonyms
1401556-16-8
1(PROPAN2YL)4(QUINOLIN8YL)46DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37DIOL
1(propan2yl)4(quinolin8yl)48dihydro1Hpyrazolo(34e)(14)thiazepine37(2H6H)dione
1401556168
1propan2yl4quinolin8yl48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
CC(C)N1C2=C(C(SCC(=O)N2)C3=CC=CC4=C3N=CC=C4)C(=O)N1
InChI=1SC18H18N4O2Sc110(2)221714(18(24)2122)16(25913(23)2017)12735116481915(11)12h381016H9H212H3(H2023)(H2124)
MFCD30715558
O=C1CSC(c2c(N1)n((nH)c2=O)C(C)C)c1cccc2c1nccc2

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Available files

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