Vitas-M small molecule compound
5-chloro-2-[(4-methylbenzyl)sulfonyl]-N-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide
Catalog ID
STK912064
SMILES C=CCSc1nnc(s1)NC(=O)c1nc(ncc1Cl)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 C18H16ClN5O3S3 MW 482.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN5O3S3/c1-3-8-28-18-24-23-16(29-18)22-15(25)14-13(19)9-20-17(21-14)30(26,27)10-12-6-4-11(2)5-7-12/h3-7,9H,1,8,10H2,2H3,(H,22,23,25)InChIKey
JPBPQZXOKLVHMJ-UHFFFAOYSA-NSynonyms
5chloro2((4methylbenzyl)sulfonyl)N(5(prop2en1ylsulfanyl)134thiadiazol2yl)pyrimidine4carboxamide
5chloro2((4methylphenyl)methylsulfonyl)N(5prop2enylsulfanyl134thiadiazol2yl)pyrimidine4carboxamide
CC1=CC=C(C=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NC3=NN=C(S3)SCC=C)Cl
InChI=1SC18H16ClN5O3S3c1382818242316(2918)2215(25)1413(19)92017(2114)30(2627)10126411(2)5712h379H1810H22H3(H222325)
MFCD07426980
ZINC000008916668
ZINC08916668
ZINC8916668
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