Vitas-M small molecule compound
4-(3-phenyl-1H-pyrazol-4-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STL313129
SMILES OC1=Nc2[nH]ncc2C(SC1)c1c[nH]nc1c1ccccc1
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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 C15H13N5OS MW 311.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N5OS/c21-12-8-22-14(11-7-17-20-15(11)18-12)10-6-16-19-13(10)9-4-2-1-3-5-9/h1-7,14H,8H2,(H,16,19)(H2,17,18,20,21)InChIKey
AMTQQZVRXZKMGT-UHFFFAOYSA-NSynonyms
1401555-82-51401555825
4(3phenyl1Hpyrazol4yl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
4(5phenyl1Hpyrazol4yl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
C1C(=O)N=C2C(=CNN2)C(S1)C3=C(NN=C3)C4=CC=CC=C4
InChI=1SC15H13N5OSc211282214(117172015(11)1812)106161913(10)9421359h1714H8H2(H1619)(H217182021)
MFCD28029924
OC1=Nc2(nH)ncc2C(SC1)c1c(nH)nc1c1ccccc1
ZINC000079480207
ZINC000079480210
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