N-[[4-(butanoylamino)phenyl]carbamothioyl]-2-phenethyloxy-benzamide

Systemtic Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-2-phenethyloxy-benzamide CAS Name: N-[[4-(1-oxobutylamino)anilino]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-2-phenethyloxybenzamide Traditional Name: N-[(4-butyramidophenyl)thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-2-8-24(30)27-20-13-15-21(16-14-20)28-26(33)29-25(31)22-11-6-7-12-23(22)32-18-17-19-9-4-3-5-10-19/h3-7,9-16H,2,8,17-18H2,1H3,(H,27,30)(H2,28,29,31,33)