Vitas-M small molecule compound
N-{[5-({2-[(3,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}-3-methylbenzamide
Catalog ID
STK119778
SMILES C=CCn1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1CNC(=O)c1cccc(c1)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 C22H21Cl2N5O2S MW 490.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Cl2N5O2S/c1-3-7-29-19(12-25-21(31)15-6-4-5-14(2)8-15)27-28-22(29)32-13-20(30)26-18-10-16(23)9-17(24)11-18/h3-6,8-11H,1,7,12-13H2,2H3,(H,25,31)(H,26,30)InChIKey
CSVYUGAUNFGWSQ-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2CC=C)SCC(=O)NC3=CC(=CC(=C3)Cl)Cl
InChI=1SC22H21Cl2N5O2Sc1372919(122521(31)1564514(2)815)272822(29)321320(30)26181016(23)917(24)1118h36811H171213H22H3(H2531)(H2630)
MFCD04218625
N((5((2((35DICHLOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
N((5(2(35DICHLOROANILINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
ZINC000001113175
ZINC01113175
ZINC1113175
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