Vitas-M small molecule compound
7-hydroxy-4-(4-methoxyphenyl)-1-(pentan-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL148379
SMILES CCC(n1[nH]c(=O)c2c1N=C(O)CSC2c1ccc(cc1)OC)CC
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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 C18H23N3O3S MW 361.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O3S/c1-4-12(5-2)21-17-15(18(23)20-21)16(25-10-14(22)19-17)11-6-8-13(24-3)9-7-11/h6-9,12,16H,4-5,10H2,1-3H3,(H,19,22)(H,20,23)InChIKey
REPAKQAIRXRIDC-UHFFFAOYSA-NSynonyms
577987-00-9(4S)4(4METHOXYPHENYL)1(PENTAN3YL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
4(4METHOXYPHENYL)1PENTAN3YL48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
577987009
7hydroxy4(4methoxyphenyl)1(pentan3yl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
CCC(CC)N1C2=C(C(SCC(=O)N2)C3=CC=C(C=C3)OC)C(=O)N1
CCC(n1(nH)c(=O)c2c1N=C(O)CSC2c1ccc(cc1)OC)CC
InChI=1SC18H23N3O3Sc1412(52)211715(18(23)2021)16(251014(22)1917)116813(243)9711h691216H4510H213H3(H1922)(H2023)
MFCD04075033
ZINC000005642612
ZINC000005642656
Check stock
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