Vitas-M small molecule compound

2-[(4-methylphenyl)amino]-8-(propoxymethyl)-7-oxa-1-thia-3-azaspiro[4.4]non-2-ene-4,6-dione

Catalog ID
STK776659
SMILES CCCOCC1OC(=O)C2(C1)SC(=NC2=O)Nc1ccc(cc1)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 C17H20N2O4S MW 348.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S/c1-3-8-22-10-13-9-17(15(21)23-13)14(20)19-16(24-17)18-12-6-4-11(2)5-7-12/h4-7,13H,3,8-10H2,1-2H3,(H,18,19,20)
InChIKey
VRJYEHGOYYFFMJ-UHFFFAOYSA-N
Synonyms
695204-52-5
(5R8R)2((4METHYLPHENYL)AMINO)8(PROPOXYMETHYL)7OXA1THIA3AZASPIRO(44)NON2ENE46DIONE
(5S8R)2((4METHYLPHENYL)AMINO)8(PROPOXYMETHYL)7OXA1THIA3AZASPIRO(44)NON2ENE46DIONE
(5S8S)2((4METHYLPHENYL)AMINO)8(PROPOXYMETHYL)7OXA1THIA3AZASPIRO(44)NON2ENE46DIONE
2((4methylphenyl)amino)8(propoxymethyl)7oxa1thia3azaspiro(44)non2ene46dione
2(4methylanilino)8(propoxymethyl)7oxa1thia3azaspiro(44)non2ene46dione
8(4METHYLANILINO)2(PROPOXYMETHYL)3OXA9THIA7AZASPIRO(44)NON7ENE46DIONE
8(propoxymethyl)2(ptolylamino)7oxa1thia3azaspiro(44)non2ene46dione
CCCOCC1CC2(C(=O)N=C(S2)NC3=CC=C(C=C3)C)C(=O)O1
InChI=1SC17H20N2O4Sc138221013917(15(21)2313)14(20)1916(2417)18126411(2)5712h4713H3810H212H3(H181920)
MFCD05259312
SPIRO(44)NON2ENE46DIONE8PROPOXYMETHYL2(PTOLYLAMINO)7OXA1THIA3AZA
ZINC000009350691
ZINC000017247327

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.