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

Systemtic Name: N-[[2-(2-methylpropoxy)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[(2-isobutoxyphenyl)carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[2-(2-methylpropoxy)anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[2-(2-methylpropoxy)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[(2-isobutoxyphenyl)thiocarbamoyl]-4-propoxy-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC(C)C

InChI

InChI=1S/C21H26N2O3S/c1-4-13-25-17-11-9-16(10-12-17)20(24)23-21(27)22-18-7-5-6-8-19(18)26-14-15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H2,22,23,24,27)