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

Systemtic Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide CAS Name: N-[[3-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[[3-(3-phenylpropoxy)phenyl]thiocarbamoyl]benzamide Formula: C26H28N2O2S MolecularWeight: 432.57772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O2S/c1-19(2)21-13-15-22(16-14-21)25(29)28-26(31)27-23-11-6-12-24(18-23)30-17-7-10-20-8-4-3-5-9-20/h3-6,8-9,11-16,18-19H,7,10,17H2,1-2H3,(H2,27,28,29,31)