Vitas-M small molecule compound
4-(3,4-dichlorophenyl)-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK646099
SMILES OC1=Nc2n[nH]cc2C(SC1)c1ccc(c(c1)Cl)Cl
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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 C12H9Cl2N3OS MW 314.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9Cl2N3OS/c13-8-2-1-6(3-9(8)14)11-7-4-15-17-12(7)16-10(18)5-19-11/h1-4,11H,5H2,(H2,15,16,17,18)InChIKey
UGPVNWGKWLWVHL-UHFFFAOYSA-NSynonyms
1172448-90-61172448906
4(34dichlorophenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
4(34dichlorophenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
C1C(=O)N=C2C(=CNN2)C(S1)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC12H9Cl2N3OSc138216(39(8)14)1174151712(7)1610(18)51911h1411H5H2(H215161718)
MFCD18164137
OC1=Nc2n(nH)cc2C(SC1)c1ccc(c(c1)Cl)Cl
ZINC000020724907
ZINC000020724911
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