Vitas-M small molecule compound

methyl 4-{(E)-[3-(2-{[2-(dimethylamino)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}benzoate

Catalog ID
STK617719
SMILES COC(=O)c1ccc(cc1)/C=C\1/SC(=O)N(C1=O)CC(=O)NCCN(C)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 C18H21N3O5S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O5S/c1-20(2)9-8-19-15(22)11-21-16(23)14(27-18(21)25)10-12-4-6-13(7-5-12)17(24)26-3/h4-7,10H,8-9,11H2,1-3H3,(H,19,22)/b14-10+
InChIKey
AJOHTEPAPRDQJB-GXDHUFHOSA-N
Synonyms
951983-02-1
(E)methyl4((3(2((2(dimethylamino)ethyl)amino)2oxoethyl)24dioxothiazolidin5ylidene)methyl)benzoate
951983021
CN(C)CCNC(=O)CN1C(=O)C(=CC2=CC=C(C=C2)C(=O)OC)SC1=O
COC(=O)c1ccc(cc1)C=C1SC(=O)N(C1=O)CC(=O)NCCN(C)C
InChI=1SC18H21N3O5Sc120(2)981915(22)112116(23)14(2718(21)25)10124613(7512)17(24)263h4710H8911H213H3(H1922)b1410+
methyl4((E)(3(2((2(dimethylamino)ethyl)amino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)benzoate
methyl4((E)(3(2(2(dimethylamino)ethylamino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)benzoate
MFCD09855545
ZINC000013722833
ZINC13722833

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Available files

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