Vitas-M small molecule compound
3-phenyl-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Catalog ID
STK643752
SMILES CC(c1n[nH]/c(=N/C(=O)C2=C(SCCO2)c2ccccc2)/s1)C
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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 C16H17N3O2S2 MW 347.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O2S2/c1-10(2)15-18-19-16(23-15)17-14(20)12-13(22-9-8-21-12)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,17,19,20)InChIKey
GFIANRWCNFTFAQ-UHFFFAOYSA-NSynonyms
1010903-30-61010903306
3phenylN((2Z)5(propan2yl)134thiadiazol2(3H)ylidene)56dihydro14oxathiine2carboxamide
5phenylN(5propan2yl134thiadiazol2yl)23dihydro14oxathiine6carboxamide
CC(C)C1=NN=C(S1)NC(=O)C2=C(SCCO2)C3=CC=CC=C3
CC(c1n(nH)c(=NC(=O)C2=C(SCCO2)c2ccccc2)s1)C
InChI=1SC16H17N3O2S2c110(2)15181916(2315)1714(20)1213(22982112)116435711h3710H89H212H3(H171920)
MFCD18163413
ZINC000012390062
ZINC12390062
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