4-cyano-N-[(4-pentoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 4-cyano-N-[(4-pentoxyphenyl)carbamothioyl]benzamide Openeye Name: 4-cyano-N-[(4-pentoxyphenyl)carbamothioyl]benzamide CAS Name: 4-cyano-N-[(4-pentoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-cyano-N-[(4-pentoxyphenyl)carbamothioyl]benzamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]-4-cyano-benzamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H21N3O2S/c1-2-3-4-13-25-18-11-9-17(10-12-18)22-20(26)23-19(24)16-7-5-15(14-21)6-8-16/h5-12H,2-4,13H2,1H3,(H2,22,23,24,26)