Vitas-M small molecule compound
3-methyl-4-(3-phenoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK933483
SMILES OC1=Nc2[nH]nc(c2C(SC1)c1cccc(c1)Oc1ccccc1)C
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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 C19H17N3O2S MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O2S/c1-12-17-18(25-11-16(23)20-19(17)22-21-12)13-6-5-9-15(10-13)24-14-7-3-2-4-8-14/h2-10,18H,11H2,1H3,(H2,20,21,22,23)InChIKey
IUDUVFHTZNCJQU-UHFFFAOYSA-NSynonyms
1224167-76-31224167763
3methyl4(3phenoxyphenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
3methyl4(3phenoxyphenyl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
CC1=C2C(SCC(=O)N=C2NN1)C3=CC(=CC=C3)OC4=CC=CC=C4
InChI=1SC19H17N3O2Sc1121718(251116(23)2019(17)222112)1365915(1013)24147324814h21018H11H21H3(H220212223)
MFCD18177520
OC1=Nc2(nH)nc(c2C(SC1)c1cccc(c1)Oc1ccccc1)C
ZINC000044893848
ZINC000044893851
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