N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[[4-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C22H25N3O3S/c1-15(2)16-3-5-17(6-4-16)20(26)24-22(29)23-19-9-7-18(8-10-19)21(27)25-11-13-28-14-12-25/h3-10,15H,11-14H2,1-2H3,(H2,23,24,26,29)