3-butoxy-N-[(3-propan-2-yloxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[(3-propan-2-yloxyphenyl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(3-isopropoxyphenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(3-propan-2-yloxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(3-propan-2-yloxyphenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(3-isopropoxyphenyl)thiocarbamoyl]benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OC(C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OC(C)C

InChI

InChI=1S/C21H26N2O3S/c1-4-5-12-25-18-10-6-8-16(13-18)20(24)23-21(27)22-17-9-7-11-19(14-17)26-15(2)3/h6-11,13-15H,4-5,12H2,1-3H3,(H2,22,23,24,27)