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

Systemtic Name: 3-(2-methylpropoxy)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Openeye Name: 3-isobutoxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide CAS Name: 3-(2-methylpropoxy)-N-[[4-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-methylpropoxy)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Traditional Name: 3-isobutoxy-N-[[4-(3-phenylpropoxy)phenyl]thiocarbamoyl]benzamide Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

InChI

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