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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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