Vitas-M small molecule compound
1-cycloheptyl-7-hydroxy-4-phenyl-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STK561413
SMILES OC1=Nc2c(C(SC1)c1ccccc1)c(=O)[nH]n2C1CCCCCC1
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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 C19H23N3O2S MW 357.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O2S/c23-15-12-25-17(13-8-4-3-5-9-13)16-18(20-15)22(21-19(16)24)14-10-6-1-2-7-11-14/h3-5,8-9,14,17H,1-2,6-7,10-12H2,(H,20,23)(H,21,24)InChIKey
BXEUNNJPSJCGFG-UHFFFAOYSA-NSynonyms
672332-33-1(4R)1CYCLOHEPTYL4PHENYL48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
1CYCLOHEPTYL4PHENYL48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
1cycloheptyl7hydroxy4phenyl1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
672332331
C1CCCC(CC1)N2C3=C(C(SCC(=O)N3)C4=CC=CC=C4)C(=O)N2
InChI=1SC19H23N3O2Sc2315122517(138435913)1618(2015)22(2119(16)24)141061271114h35891417H12671012H2(H2023)(H2124)
MFCD04074458
OC1=Nc2c(C(SC1)c1ccccc1)c(=O)(nH)n2C1CCCCCC1
ZINC000005769760
ZINC000005769839
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