Vitas-M small molecule compound
(2E)-3-phenyl-N-{[4-(pyrrolidin-1-yl)phenyl]carbamothioyl}prop-2-enamide
Catalog ID
STK172873
SMILES S=C(Nc1ccc(cc1)N1CCCC1)NC(=O)/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 C20H21N3OS MW 351.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3OS/c24-19(13-8-16-6-2-1-3-7-16)22-20(25)21-17-9-11-18(12-10-17)23-14-4-5-15-23/h1-3,6-13H,4-5,14-15H2,(H2,21,22,24,25)/b13-8+InChIKey
NZWRNTCWUUZVLZ-MDWZMJQESA-NSynonyms
6620-28-6(2E)3PHENYLN((4(PYRROLIDIN1YL)PHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
(E)3PHENYLN((4PYRROLIDIN1YLPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
6620286
C1CCN(C1)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=CC=C3
InChI=1SC20H21N3OSc2419(138166213716)2220(25)211791118(121017)2314451523h13613H451415H2(H221222425)b138+
MFCD02923698
S=C(Nc1ccc(cc1)N1CCCC1)NC(=O)C=Cc1ccccc1
ZINC000001183412
ZINC01183412
ZINC1183412
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