N-[(3-butoxyphenyl)carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[(3-butoxyphenyl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(3-butoxyphenyl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[(3-butoxyanilino)-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(3-butoxyphenyl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(3-butoxyphenyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC

InChI

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