3-(2-ethoxyethoxy)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-(2-ethoxyethoxy)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Openeye Name: 3-(2-ethoxyethoxy)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide CAS Name: 3-(2-ethoxyethoxy)-N-[[4-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-ethoxyethoxy)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Traditional Name: 3-(2-ethoxyethoxy)-N-[[4-(3-phenylpropoxy)phenyl]thiocarbamoyl]benzamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

Isomeric SMILES

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O4S/c1-2-31-18-19-33-25-12-6-11-22(20-25)26(30)29-27(34)28-23-13-15-24(16-14-23)32-17-7-10-21-8-4-3-5-9-21/h3-6,8-9,11-16,20H,2,7,10,17-19H2,1H3,(H2,28,29,30,34)