Vitas-M small molecule compound
3-{(5Z)-4-oxo-5-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid
Catalog ID
STK703758
SMILES OC(=O)CCN1C(=S)S/C(=C\c2c[nH]nc2c2ccccc2)/C1=O
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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 C16H13N3O3S2 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O3S2/c20-13(21)6-7-19-15(22)12(24-16(19)23)8-11-9-17-18-14(11)10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H,17,18)(H,20,21)/b12-8-InChIKey
AAYIXDPBOYLITQ-WQLSENKSSA-NSynonyms
(Z)3(4oxo5((3phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin3yl)propanoicacid
3((5Z)4oxo5((3phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin3yl)propanoicacid
3((5Z)4OXO5((5PHENYL1HPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
C1=CC=C(C=C1)C2=C(C=NN2)C=C3C(=O)N(C(=S)S3)CCC(=O)O
InChI=1SC16H13N3O3S2c2013(21)671915(22)12(2416(19)23)8119171814(11)104213510h1589H67H2(H1718)(H2021)b128
MFCD03663099
OC(=O)CCN1C(=S)SC(=Cc2c(nH)nc2c2ccccc2)C1=O
ZINC000004980767
ZINC4980767
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