Vitas-M small molecule compound
(2E)-3-phenyl-N-{[2-(pyrrolidin-1-yl)phenyl]carbamothioyl}prop-2-enamide
Catalog ID
STK254642
SMILES O=C(NC(=S)Nc1ccccc1N1CCCC1)/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(13-12-16-8-2-1-3-9-16)22-20(25)21-17-10-4-5-11-18(17)23-14-6-7-15-23/h1-5,8-13H,6-7,14-15H2,(H2,21,22,24,25)/b13-12+InChIKey
QAQSLKTZGKTGIQ-OUKQBFOZSA-NSynonyms
(2E)3phenylN((2(pyrrolidin1yl)phenyl)carbamothioyl)prop2enamide
(E)3PHENYLN((2PYRROLIDIN1YLPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C=CC3=CC=CC=C3
InChI=1SC20H21N3OSc2419(1312168213916)2220(25)211710451118(17)2314671523h15813H671415H2(H221222425)b1312+
MFCD03567256
O=C(NC(=S)Nc1ccccc1N1CCCC1)C=Cc1ccccc1
ZINC000001124127
ZINC01124127
ZINC1124127
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