Vitas-M small molecule compound

2-nitro-N-{(5Z)-4-oxo-5-[4-(prop-2-en-1-yloxy)benzylidene]-2-thioxo-1,3-thiazolidin-3-yl}benzamide

Catalog ID
STK545114
SMILES C=CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccccc1[N+](=O)[O-]

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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 C20H15N3O5S2 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O5S2/c1-2-11-28-14-9-7-13(8-10-14)12-17-19(25)22(20(29)30-17)21-18(24)15-5-3-4-6-16(15)23(26)27/h2-10,12H,1,11H2,(H,21,24)/b17-12-
InChIKey
ULBCQYFCCOPVMQ-ATVHPVEESA-N
Synonyms
641998-35-8
(Z)N(5(4(allyloxy)benzylidene)4oxo2thioxothiazolidin3yl)2nitrobenzamide
2NITRON((5Z)4OXO5((4PROP2ENOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)BENZAMIDE
2nitroN((5Z)4oxo5(4(prop2en1yloxy)benzylidene)2thioxo13thiazolidin3yl)benzamide
641998358
C=CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3(N+)(=O)(O)
C=CCOc1ccc(cc1)C=C1SC(=S)N(C1=O)NC(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC20H15N3O5S2c121128149713(81014)121719(25)22(20(29)3017)2118(24)15534616(15)23(26)27h21012H111H2(H2124)b1712
MFCD03664011
ZINC000001821430
ZINC01821430
ZINC1821430

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Available files

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