Vitas-M small molecule compound
N-[(3S,4R)-4-hydroxytetrahydrothiophen-3-yl]-3-[(5E)-5-(4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]propanamide
Catalog ID
STK637591
SMILES COc1ccc(cc1)/C=C\1/SC(=O)N(C1=O)CCC(=O)N[C@@H]1CSC[C@@H]1O
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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 C18H20N2O5S2 MW 408.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O5S2/c1-25-12-4-2-11(3-5-12)8-15-17(23)20(18(24)27-15)7-6-16(22)19-13-9-26-10-14(13)21/h2-5,8,13-14,21H,6-7,9-10H2,1H3,(H,19,22)/b15-8+/t13-,14+/m1/s1InChIKey
RFSPTOCXCPKTDP-IJEKBPOVSA-NSynonyms
COC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CCC(=O)NC3CSCC3O
COc1ccc(cc1)C=C1SC(=O)N(C1=O)CCC(=O)N(C@@H)1CSC(C@@H)1O
InChI=1SC18H20N2O5S2c125124211(3512)81517(23)20(18(24)2715)7616(22)19139261014(13)21h258131421H67910H21H3(H1922)b158+t1314+m1s1
MFCD18246628
N((3S4R)4hydroxytetrahydrothiophen3yl)3((5E)5(4methoxybenzylidene)24dioxo13thiazolidin3yl)propanamide
N((3S4R)4hydroxytetrahydrothiophen3yl)3((E)5(4methoxybenzylidene)24dioxothiazolidin3yl)propanamide
N((3S4R)4hydroxythiolan3yl)3((5E)5((4methoxyphenyl)methylidene)24dioxo13thiazolidin3yl)propanamide
ZINC000012391056
ZINC12391056
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