Vitas-M small molecule compound
7-hydroxy-1-(propan-2-yl)-4-[4-(propan-2-yl)phenyl]-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL309130
SMILES OC1=Nc2n([nH]c(=O)c2C(SC1)c1ccc(cc1)C(C)C)C(C)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 C18H23N3O2S MW 345.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O2S/c1-10(2)12-5-7-13(8-6-12)16-15-17(19-14(22)9-24-16)21(11(3)4)20-18(15)23/h5-8,10-11,16H,9H2,1-4H3,(H,19,22)(H,20,23)InChIKey
AMQXHKIDOSKESL-UHFFFAOYSA-NSynonyms
1435988-25-21435988252
1propan2yl4(4propan2ylphenyl)48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
7hydroxy1(propan2yl)4(4(propan2yl)phenyl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
CC(C)C1=CC=C(C=C1)C2C3=C(NC(=O)CS2)N(NC3=O)C(C)C
InChI=1SC18H23N3O2Sc110(2)125713(8612)161517(1914(22)92416)21(11(3)4)2018(15)23h58101116H9H214H3(H1922)(H2023)
MFCD28028747
OC1=Nc2n((nH)c(=O)c2C(SC1)c1ccc(cc1)C(C)C)C(C)C
ZINC000095472341
ZINC000095472342
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