Vitas-M small molecule compound
3-phenyl-N-[(2Z)-4,5,6,7-tetrahydro-1,3-benzothiazol-2(3H)-ylidene]-5,6-dihydro-1,4-oxathiine-2-carboxamide 4,4-dioxide
Catalog ID
STK658340
SMILES O=C(C1=C(c2ccccc2)S(=O)(=O)CCO1)/N=c/1\sc2c([nH]1)CCCC2
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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 C18H18N2O4S2 MW 390.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S2/c21-17(20-18-19-13-8-4-5-9-14(13)25-18)15-16(12-6-2-1-3-7-12)26(22,23)11-10-24-15/h1-3,6-7H,4-5,8-11H2,(H,19,20,21)InChIKey
JFCMPXMGRHENJL-UHFFFAOYSA-NSynonyms
1144442-58-91144442589
3phenylN((2Z)4567tetrahydro13benzothiazol2(3H)ylidene)56dihydro14oxathiine2carboxamide44dioxide
44dioxo5phenylN(4567tetrahydro13benzothiazol2yl)23dihydro14oxathiine6carboxamide
C1CCC2=C(C1)N=C(S2)NC(=O)C3=C(S(=O)(=O)CCO3)C4=CC=CC=C4
InChI=1SC18H18N2O4S2c2117(20181913845914(13)2518)1516(126213712)26(2223)11102415h1367H45811H2(H192021)
MFCD18168345
O=C(C1=C(c2ccccc2)S(=O)(=O)CCO1)N=c1sc2c((nH)1)CCCC2
ZINC000031811794
ZINC31811794
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