Vitas-M small molecule compound
(5Z)-5-{(2E)-3-[4-(dimethylamino)phenyl]prop-2-en-1-ylidene}-3-(4-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL418519
SMILES CN(c1ccc(cc1)/C=C/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)[N+](=O)[O-])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 C20H17N3O3S2 MW 411.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O3S2/c1-21(2)15-8-6-14(7-9-15)4-3-5-18-19(24)22(20(27)28-18)16-10-12-17(13-11-16)23(25)26/h3-13H,1-2H3/b4-3+,18-5-InChIKey
BNYXHXFAPPJMHG-ONCSWLTESA-NSynonyms
(5Z)5((2E)3(4(dimethylamino)phenyl)prop2en1ylidene)3(4nitrophenyl)2thioxo13thiazolidin4one
(5Z)5((E)3(4(dimethylamino)phenyl)prop2enylidene)3(4nitrophenyl)2sulfanylidene13thiazolidin4one
CN(C)C1=CC=C(C=C1)C=CC=C2C(=O)N(C(=S)S2)C3=CC=C(C=C3)(N+)(=O)(O)
CN(c1ccc(cc1)C=CC=C1SC(=S)N(C1=O)c1ccc(cc1)(N+)(=O)(O))C
InChI=1SC20H17N3O3S2c121(2)158614(7915)4351819(24)22(20(27)2818)16101217(131116)23(25)26h313H12H3b43+185
MFCD30707256
ZINC000033400717
ZINC33400717
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