Vitas-M small molecule compound
(2E)-N-{[3-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl}-3-phenylprop-2-enamide
Catalog ID
STK021560
SMILES O=C(NC(=S)Nc1cccc(c1)c1nc2c(s1)cccc2)/C=C/c1ccccc1
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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 C23H17N3OS2 MW 415.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3OS2/c27-21(14-13-16-7-2-1-3-8-16)26-23(28)24-18-10-6-9-17(15-18)22-25-19-11-4-5-12-20(19)29-22/h1-15H,(H2,24,26,27,28)/b14-13+InChIKey
KKMXKWXCMDVETL-BUHFOSPRSA-NSynonyms
(2E)N((3(13BENZOTHIAZOL2YL)PHENYL)CARBAMOTHIOYL)3PHENYLPROP2ENAMIDE
(E)N((3(13BENZOTHIAZOL2YL)PHENYL)CARBAMOTHIOYL)3PHENYLPROP2ENAMIDE
C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3
InChI=1SC23H17N3OS2c2721(1413167213816)2623(28)2418106917(1518)22251911451220(19)2922h115H(H224262728)b1413+
MFCD02187673
O=C(NC(=S)Nc1cccc(c1)c1nc2c(s1)cccc2)C=Cc1ccccc1
STK021560
ZINC000004561566
ZINC04561566
ZINC4561566
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