Vitas-M small molecule compound
3-phenyl-N-[(2Z)-5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Catalog ID
STK633717
SMILES C=CCSc1n[nH]/c(=N/C(=O)C2=C(SCCO2)c2ccccc2)/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 C16H15N3O2S3 MW 377.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O2S3/c1-2-9-23-16-19-18-15(24-16)17-14(20)12-13(22-10-8-21-12)11-6-4-3-5-7-11/h2-7H,1,8-10H2,(H,17,18,20)InChIKey
YGRDNOOQUWIMQE-UHFFFAOYSA-NSynonyms
1010903-74-81010903748
3phenylN((2Z)5(prop2en1ylsulfanyl)134thiadiazol2(3H)ylidene)56dihydro14oxathiine2carboxamide
5phenylN(5prop2enylsulfanyl134thiadiazol2yl)23dihydro14oxathiine6carboxamide
C=CCSC1=NN=C(S1)NC(=O)C2=C(SCCO2)C3=CC=CC=C3
C=CCSc1n(nH)c(=NC(=O)C2=C(SCCO2)c2ccccc2)s1
InChI=1SC16H15N3O2S3c1292316191815(2416)1714(20)1213(221082112)116435711h27H1810H2(H171820)
MFCD18160183
ZINC000012321879
ZINC12321879
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