N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[3-[(1-oxo-2-phenylethyl)amino]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[[3-[(2-phenylacetyl)amino]phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O3S/c1-2-15-31-22-13-11-19(12-14-22)24(30)28-25(32)27-21-10-6-9-20(17-21)26-23(29)16-18-7-4-3-5-8-18/h3-14,17H,2,15-16H2,1H3,(H,26,29)(H2,27,28,30,32)