N-[(2-morpholin-4-ylphenyl)carbamothioyl]-3-propan-2-yloxy-benzamide

Systemtic Name: N-[(2-morpholin-4-ylphenyl)carbamothioyl]-3-propan-2-yloxy-benzamide Openeye Name: 3-isopropoxy-N-[(2-morpholinophenyl)carbamothioyl]benzamide CAS Name: N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-3-propan-2-yloxybenzamide IUPAC Name: N-[(2-morpholin-4-ylphenyl)carbamothioyl]-3-propan-2-yloxybenzamide Traditional Name: 3-isopropoxy-N-[(2-morpholinophenyl)thiocarbamoyl]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3

InChI

InChI=1S/C21H25N3O3S/c1-15(2)27-17-7-5-6-16(14-17)20(25)23-21(28)22-18-8-3-4-9-19(18)24-10-12-26-13-11-24/h3-9,14-15H,10-13H2,1-2H3,(H2,22,23,25,28)