Vitas-M small molecule compound
(5E)-3-benzyl-5-{3-chloro-5-ethoxy-4-[3-(4-ethylphenoxy)propoxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK079198
SMILES CCOc1cc(/C=C\2/SC(=S)N(C2=O)Cc2ccccc2)cc(c1OCCCOc1ccc(cc1)CC)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 C30H30ClNO4S2 MW 568.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30ClNO4S2/c1-3-21-11-13-24(14-12-21)35-15-8-16-36-28-25(31)17-23(18-26(28)34-4-2)19-27-29(33)32(30(37)38-27)20-22-9-6-5-7-10-22/h5-7,9-14,17-19H,3-4,8,15-16,20H2,1-2H3/b27-19+InChIKey
VNROQLQZCCQLAE-ZXVVBBHZSA-NSynonyms
(5E)3benzyl5((3chloro5ethoxy4(3(4ethylphenoxy)propoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)3BENZYL5(3CHLORO5ETHOXY4(3(4ETHYLPHENOXY)PROPOXY)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCC1=CC=C(C=C1)OCCCOC2=C(C=C(C=C2Cl)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)OCC
CCOc1cc(C=C2SC(=S)N(C2=O)Cc2ccccc2)cc(c1OCCCOc1ccc(cc1)CC)Cl
InChI=1SC30H30ClNO4S2c1321111324(141221)3515816362825(31)1723(1826(28)3442)192729(33)32(30(37)3827)202296571022h579141719H348151620H212H3b2719+
MFCD08672800
STK079198
ZINC000097959056
ZINC97959056
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