4-(3-methylbutoxy)-N-[(4-phenethyloxyphenyl)carbamothioyl]benzamide

Systemtic Name: 4-(3-methylbutoxy)-N-[(4-phenethyloxyphenyl)carbamothioyl]benzamide Openeye Name: 4-isopentyloxy-N-[(4-phenethyloxyphenyl)carbamothioyl]benzamide CAS Name: 4-(3-methylbutoxy)-N-[(4-phenethyloxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-(3-methylbutoxy)-N-[(4-phenethyloxyphenyl)carbamothioyl]benzamide Traditional Name: 4-isoamoxy-N-[(4-phenethyloxyphenyl)thiocarbamoyl]benzamide Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O3S/c1-20(2)16-18-31-24-12-8-22(9-13-24)26(30)29-27(33)28-23-10-14-25(15-11-23)32-19-17-21-6-4-3-5-7-21/h3-15,20H,16-19H2,1-2H3,(H2,28,29,30,33)