N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[(3-isobutoxyphenyl)carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[3-(2-methylpropoxy)anilino]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[(3-isobutoxyphenyl)thiocarbamoyl]benzamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=CC=C2)OCC(C)C

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=CC=C2)OCC(C)C

InChI

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