Vitas-M small molecule compound
propan-2-yl 3-[({[5-({[(3,4-dichlorophenyl)carbonyl]amino}methyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK186607
SMILES C=CCn1c(SCC(=O)Nc2cccc(c2)C(=O)OC(C)C)nnc1CNC(=O)c1ccc(c(c1)Cl)Cl
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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 C25H25Cl2N5O4S MW 562.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25Cl2N5O4S/c1-4-10-32-21(13-28-23(34)16-8-9-19(26)20(27)12-16)30-31-25(32)37-14-22(33)29-18-7-5-6-17(11-18)24(35)36-15(2)3/h4-9,11-12,15H,1,10,13-14H2,2-3H3,(H,28,34)(H,29,33)InChIKey
DCYYTOZWFAYNBF-UHFFFAOYSA-NSynonyms
CC(C)OC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC(=C(C=C3)Cl)ClPROPAN2YL3((((5((((34DICHLOROPHENYL)CARBONYL)AMINO)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
PROPAN2YL3((2((5(((34DICHLOROBENZOYL)AMINO)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
Registry IDs
MFCD04385362ZINC000059608128
ZINC59608128
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