Vitas-M small molecule compound
4-(2,3,4-trimethoxyphenyl)-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK635051
SMILES COc1c(OC)c(OC)ccc1C1SCC(=Nc2c1c[nH]n2)O
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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 C15H17N3O4S MW 335.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O4S/c1-20-10-5-4-8(12(21-2)13(10)22-3)14-9-6-16-18-15(9)17-11(19)7-23-14/h4-6,14H,7H2,1-3H3,(H2,16,17,18,19)InChIKey
NCRRTMSMQCLYJM-UHFFFAOYSA-NSynonyms
1172694-66-41172694664
4(234trimethoxyphenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
4(234trimethoxyphenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
COC1=C(C(=C(C=C1)C2C3=CNNC3=NC(=O)CS2)OC)OC
COc1c(OC)c(OC)ccc1C1SCC(=Nc2c1c(nH)n2)O
InChI=1SC15H17N3O4Sc12010548(12(212)13(10)223)1496161815(9)1711(19)72314h4614H7H213H3(H216171819)
MFCD18160592
ZINC000020736199
ZINC000020736202
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