Vitas-M small molecule compound
{(5E)-5-[(1Z)-1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)butan-2-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
Catalog ID
STK378074
SMILES CC/C(=C/1\SC(=S)N(C1=O)CC(=O)O)/C=c/1\sc2c(n1CC)cc(cc2)OC
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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 C19H20N2O4S3 MW 436.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O4S3/c1-4-11(17-18(24)21(10-16(22)23)19(26)28-17)8-15-20(5-2)13-9-12(25-3)6-7-14(13)27-15/h6-9H,4-5,10H2,1-3H3,(H,22,23)/b15-8-,17-11+InChIKey
ZIJWUKZCGLJFHC-SYPDMRTPSA-NSynonyms
((5E)5((1Z)1(3ethyl5methoxy13benzothiazol2(3H)ylidene)butan2ylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5E)5((1Z)1(3ETHYL5METHOXY13BENZOTHIAZOL2YLIDENE)BUTAN2YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
CCC(=C1C(=O)N(C(=S)S1)CC(=O)O)C=C2N(C3=C(S2)C=CC(=C3)OC)CC
CCC(=C1SC(=S)N(C1=O)CC(=O)O)C=c1sc2c(n1CC)cc(cc2)OC
InChI=1SC19H20N2O4S3c1411(1718(24)21(1016(22)23)19(26)2817)81520(52)13912(253)6714(13)2715h69H4510H213H3(H2223)b1581711+
MFCD01823498
ZINC000004048107
ZINC4048107
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