Vitas-M small molecule compound
N-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-carboxamide
Catalog ID
STL157296
SMILES COc1ccc(cc1)C1(CCOCC1)C(=O)/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 C21H27N3O3S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O3S/c1-26-17-9-7-16(8-10-17)21(11-13-27-14-12-21)19(25)22-20-24-23-18(28-20)15-5-3-2-4-6-15/h7-10,15H,2-6,11-14H2,1H3,(H,22,24,25)InChIKey
XNHKLGUMLNMSKF-UHFFFAOYSA-NSynonyms
1214472-87-31214472873
COC1=CC=C(C=C1)C2(CCOCC2)C(=O)NC3=NN=C(S3)C4CCCCC4
COc1ccc(cc1)C1(CCOCC1)C(=O)N=c1(nH)nc(s1)C1CCCCC1
InChI=1SC21H27N3O3Sc126179716(81017)21(111327141221)19(25)2220242318(2820)155324615h71015H261114H21H3(H222425)
MFCD20757948
N((2Z)5cyclohexyl134thiadiazol2(3H)ylidene)4(4methoxyphenyl)tetrahydro2Hpyran4carboxamide
N(5cyclohexyl134thiadiazol2yl)4(4methoxyphenyl)oxane4carboxamide
ZINC000019661465
ZINC19661465
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