N-[(4-pentoxyphenyl)carbamothioyl]-4-phenoxy-butanamide

Systemtic Name: N-[(4-pentoxyphenyl)carbamothioyl]-4-phenoxy-butanamide Openeye Name: N-[(4-pentoxyphenyl)carbamothioyl]-4-phenoxy-butanamide CAS Name: N-[(4-pentoxyanilino)-sulfanylidenemethyl]-4-phenoxybutanamide IUPAC Name: N-[(4-pentoxyphenyl)carbamothioyl]-4-phenoxybutanamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]-4-phenoxy-butyramide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O3S/c1-2-3-7-16-26-20-14-12-18(13-15-20)23-22(28)24-21(25)11-8-17-27-19-9-5-4-6-10-19/h4-6,9-10,12-15H,2-3,7-8,11,16-17H2,1H3,(H2,23,24,25,28)