Vitas-M small molecule compound
N-[(2E)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
Catalog ID
STL313264
SMILES O=C(c1c(C)nn(c1C)C1CCS(=O)(=O)C1)/N=c/1\[nH]nc(s1)C1CCCCC1
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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 C18H25N5O3S2 MW 423.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N5O3S2/c1-11-15(12(2)23(22-11)14-8-9-28(25,26)10-14)16(24)19-18-21-20-17(27-18)13-6-4-3-5-7-13/h13-14H,3-10H2,1-2H3,(H,19,21,24)InChIKey
RVAYWLYXRQVVGR-UHFFFAOYSA-NSynonyms
1401566-71-91401566719
CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)C(=O)NC3=NN=C(S3)C4CCCCC4
InChI=1SC18H25N5O3S2c11115(12(2)23(2211)148928(2526)1014)16(24)1918212017(2718)136435713h1314H310H212H3(H192124)
MFCD28030009
N((2E)5cyclohexyl134thiadiazol2(3H)ylidene)1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazole4carboxamide
N(5cyclohexyl134thiadiazol2yl)1(11dioxothiolan3yl)35dimethylpyrazole4carboxamide
O=C(c1c(C)nn(c1C)C1CCS(=O)(=O)C1)N=c1(nH)nc(s1)C1CCCCC1
ZINC000079494886
ZINC000079494891
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