Vitas-M small molecule compound

3-chloro-N-[4-({[(4-methoxyphenyl)carbonyl]carbamothioyl}amino)phenyl]benzamide

Catalog ID
STK018571
SMILES COc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)NC(=O)c1cccc(c1)Cl

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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 C22H18ClN3O3S MW 439.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O3S/c1-29-19-11-5-14(6-12-19)20(27)26-22(30)25-18-9-7-17(8-10-18)24-21(28)15-3-2-4-16(23)13-15/h2-13H,1H3,(H,24,28)(H2,25,26,27,30)
InChIKey
IYCUIUSFQXKBBD-UHFFFAOYSA-N
Synonyms

3CHLORON(4((((4METHOXYBENZOYL)AMINO)CARBOTHIOYL)AMINO)PHENYL)BENZAMIDE
3CHLORON(4((((4METHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)PHENYL)BENZAMIDE
3chloroN(4((4methoxybenzoyl)carbamothioylamino)phenyl)benzamide
3CHLORON(4(3(4METHOXYBENZOYL)THIOUREIDO)PHENYL)BENZAMIDE
COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl
COc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)NC(=O)c1cccc(c1)Cl
InChI=1SC22H18ClN3O3Sc1291911514(61219)20(27)2622(30)25189717(81018)2421(28)1532416(23)1315h213H1H3(H2428)(H225262730)
MFCD02578212
N(((4((3CHLOROPHENYL)CARBONYLAMINO)PHENYL)AMINO)THIOXOMETHYL)(4METHOXYPHENYL)CARBOXAMIDE
STK018571
ZINC000000882080
ZINC00882080
ZINC882080

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.