N-[(3-ethanoylphenyl)carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[(3-ethanoylphenyl)carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[(3-acetylphenyl)carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[(3-acetylanilino)-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[(3-acetylphenyl)carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[(3-acetylphenyl)thiocarbamoyl]-4-heptoxy-benzamide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)C

InChI

InChI=1S/C23H28N2O3S/c1-3-4-5-6-7-15-28-21-13-11-18(12-14-21)22(27)25-23(29)24-20-10-8-9-19(16-20)17(2)26/h8-14,16H,3-7,15H2,1-2H3,(H2,24,25,27,29)