N-[[2-(2-methylpropoxy)phenyl]carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[[2-(2-methylpropoxy)phenyl]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[(2-isobutoxyphenyl)carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[2-(2-methylpropoxy)anilino]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[2-(2-methylpropoxy)phenyl]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[(2-isobutoxyphenyl)thiocarbamoyl]benzamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC(C)C

InChI

InChI=1S/C23H30N2O3S/c1-4-5-8-15-27-19-13-11-18(12-14-19)22(26)25-23(29)24-20-9-6-7-10-21(20)28-16-17(2)3/h6-7,9-14,17H,4-5,8,15-16H2,1-3H3,(H2,24,25,26,29)