Vitas-M small molecule compound
N-[(2E)-5-butyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanamide
Catalog ID
STL148069
SMILES CCCCc1n[nH]/c(=N\C(=O)CCN2C(=S)S/C(=C\c3ccc(cc3)C)/C2=O)/s1
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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 C20H22N4O2S3 MW 446.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S3/c1-3-4-5-17-22-23-19(29-17)21-16(25)10-11-24-18(26)15(28-20(24)27)12-14-8-6-13(2)7-9-14/h6-9,12H,3-5,10-11H2,1-2H3,(H,21,23,25)/b15-12-InChIKey
FYYIPOLPVYCRQM-QINSGFPZSA-NSynonyms
5667-33-45667334
CCCCc1n(nH)c(=NC(=O)CCN2C(=S)SC(=Cc3ccc(cc3)C)C2=O)s1
InChI=1SC20H22N4O2S3c134517222319(2917)2116(25)10112418(26)15(2820(24)27)12148613(2)7914h6912H351011H212H3(H212325)b1512
MFCD03800052
N((2E)5butyl134thiadiazol2(3H)ylidene)3((5Z)5(4methylbenzylidene)4oxo2thioxo13thiazolidin3yl)propanamide
N(5BUTYL134THIADIAZOL2YL)3((5Z)5((4METHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANAMIDE
ZINC000017123672
ZINC17123672
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