Vitas-M small molecule compound
4-butyl-N-[(2Z)-5-[(4-methylbenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]cyclohexanecarboxamide
Catalog ID
STK603977
SMILES CCCCC1CCC(CC1)C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)Cc1ccc(cc1)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 C21H29N3O3S2 MW 435.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O3S2/c1-3-4-5-16-10-12-18(13-11-16)19(25)22-20-23-24-21(28-20)29(26,27)14-17-8-6-15(2)7-9-17/h6-9,16,18H,3-5,10-14H2,1-2H3,(H,22,23,25)InChIKey
ZJMZHZYQBTVSDD-UHFFFAOYSA-NSynonyms
895848-01-84butylN((2Z)5((4methylbenzyl)sulfonyl)134thiadiazol2(3H)ylidene)cyclohexanecarboxamide
4butylN(5((4methylphenyl)methylsulfonyl)134thiadiazol2yl)cyclohexane1carboxamide
895848018
CCCCC1CCC(CC1)C(=O)N=c1(nH)nc(s1)S(=O)(=O)Cc1ccc(cc1)C
CCCCC1CCC(CC1)C(=O)NC2=NN=C(S2)S(=O)(=O)CC3=CC=C(C=C3)C
InChI=1SC21H29N3O3S2c134516101218(131116)19(25)2220232421(2820)29(2627)14178615(2)7917h691618H351014H212H3(H222325)
MFCD08735643
ZINC000017112333
ZINC17112333
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