N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[(3-isobutoxyphenyl)carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[3-(2-methylpropoxy)anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[(3-isobutoxyphenyl)thiocarbamoyl]-4-propoxy-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCC(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCC(C)C

InChI

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