Vitas-M small molecule compound
4-(2H-chromen-3-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STL312564
SMILES OC1=Nc2[nH]ncc2C(SC1)C1=Cc2c(OC1)cccc2
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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 C15H13N3O2S MW 299.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O2S/c19-13-8-21-14(11-6-16-18-15(11)17-13)10-5-9-3-1-2-4-12(9)20-7-10/h1-6,14H,7-8H2,(H2,16,17,18,19)InChIKey
SOSOZESYVGDJNV-UHFFFAOYSA-NSynonyms
1435986-46-11435986461
4(2Hchromen3yl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
4(2Hchromen3yl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
C1C(=CC2=CC=CC=C2O1)C3C4=CNNC4=NC(=O)CS3
InChI=1SC15H13N3O2Sc191382114(116161815(11)1713)1059312412(9)20710h1614H78H2(H216171819)
MFCD28026732
OC1=Nc2(nH)ncc2C(SC1)C1=Cc2c(OC1)cccc2
ZINC000095474890
ZINC000095474891
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