N-[[4-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[4-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[4-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[4-[(cyclohexylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[4-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[4-(cyclohexylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C26H33N3O3S MolecularWeight: 467.62352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC3CCCCC3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC3CCCCC3

InChI

InChI=1S/C26H33N3O3S/c1-2-3-9-18-32-23-13-8-7-12-22(23)25(31)29-26(33)28-21-16-14-19(15-17-21)24(30)27-20-10-5-4-6-11-20/h7-8,12-17,20H,2-6,9-11,18H2,1H3,(H,27,30)(H2,28,29,31,33)