N-[(4-hexoxyphenyl)carbamothioyl]-3-phenethyloxy-benzamide

Systemtic Name: N-[(4-hexoxyphenyl)carbamothioyl]-3-phenethyloxy-benzamide Openeye Name: N-[(4-hexoxyphenyl)carbamothioyl]-3-phenethyloxy-benzamide CAS Name: N-[(4-hexoxyanilino)-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-[(4-hexoxyphenyl)carbamothioyl]-3-phenethyloxybenzamide Traditional Name: N-[(4-hexoxyphenyl)thiocarbamoyl]-3-phenethyloxy-benzamide Formula: C28H32N2O3S MolecularWeight: 476.63028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C28H32N2O3S/c1-2-3-4-8-19-32-25-16-14-24(15-17-25)29-28(34)30-27(31)23-12-9-13-26(21-23)33-20-18-22-10-6-5-7-11-22/h5-7,9-17,21H,2-4,8,18-20H2,1H3,(H2,29,30,31,34)