Vitas-M small molecule compound
7-methyl-4-oxo-N-[(2Z)-5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4H-chromene-2-carboxamide
Catalog ID
STK848574
SMILES C=CCSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(cc3)C)/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 C16H13N3O3S2 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O3S2/c1-3-6-23-16-19-18-15(24-16)17-14(21)13-8-11(20)10-5-4-9(2)7-12(10)22-13/h3-5,7-8H,1,6H2,2H3,(H,17,18,21)InChIKey
JMDYAOGLQQSGAS-UHFFFAOYSA-NSynonyms
872869-40-47methyl4oxoN((2Z)5(prop2en1ylsulfanyl)134thiadiazol2(3H)ylidene)4Hchromene2carboxamide
872869404
C=CCSc1n(nH)c(=NC(=O)c2cc(=O)c3c(o2)cc(cc3)C)s1
CC1=CC2=C(C=C1)C(=O)C=C(O2)C(=O)NC3=NN=C(S3)SCC=C
InChI=1SC16H13N3O3S2c1362316191815(2416)1714(21)13811(20)10549(2)712(10)2213h3578H16H22H3(H171821)
MFCD07207416
ZINC000016996438
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