Vitas-M small molecule compound
methyl 4-({[1-(4-chlorophenyl)-3-heptyl-5-oxo-2-thioxoimidazolidin-4-yl]acetyl}amino)benzoate
Catalog ID
STK065565
SMILES CCCCCCCN1C(CC(=O)Nc2ccc(cc2)C(=O)OC)C(=O)N(C1=S)c1ccc(cc1)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 C26H30ClN3O4S MW 516.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30ClN3O4S/c1-3-4-5-6-7-16-29-22(24(32)30(26(29)35)21-14-10-19(27)11-15-21)17-23(31)28-20-12-8-18(9-13-20)25(33)34-2/h8-15,22H,3-7,16-17H2,1-2H3,(H,28,31)InChIKey
NQWCRAJCBSASTG-UHFFFAOYSA-NSynonyms
585522-53-8585522538
CCCCCCCN1C(C(=O)N(C1=S)C2=CC=C(C=C2)Cl)CC(=O)NC3=CC=C(C=C3)C(=O)OC
CCCCCCCN1C(CC(=O)Nc2ccc(cc2)C(=O)OC)C(=O)N(C1=S)c1ccc(cc1)Cl
InChI=1SC26H30ClN3O4Sc134567162922(24(32)30(26(29)35)21141019(27)111521)1723(31)282012818(91320)25(33)342h81522H371617H212H3(H2831)
METHYL4(((1(4CHLOROPHENYL)3HEPTYL5OXO2THIOXOIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
METHYL4((2(1(4CHLOROPHENYL)3HEPTYL5OXO2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
methyl4(2(1(4chlorophenyl)3heptyl5oxo2thioxoimidazolidin4yl)acetamido)benzoate
MFCD02142370
STK065565
ZINC000097952018
ZINC000097952019
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