3-(2-methylpropoxy)-N-[(3-propoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-(2-methylpropoxy)-N-[(3-propoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-isobutoxy-N-[(3-propoxyphenyl)carbamothioyl]benzamide CAS Name: 3-(2-methylpropoxy)-N-[(3-propoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-methylpropoxy)-N-[(3-propoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-isobutoxy-N-[(3-propoxyphenyl)thiocarbamoyl]benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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