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

Systemtic Name: N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]-3-propan-2-yloxy-benzamide Openeye Name: 3-isopropoxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]-3-propan-2-yloxybenzamide IUPAC Name: N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]-3-propan-2-yloxybenzamide Traditional Name: 3-isopropoxy-N-[[4-(3-phenylpropoxy)phenyl]thiocarbamoyl]benzamide Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

InChI

InChI=1S/C26H28N2O3S/c1-19(2)31-24-12-6-11-21(18-24)25(29)28-26(32)27-22-13-15-23(16-14-22)30-17-7-10-20-8-4-3-5-9-20/h3-6,8-9,11-16,18-19H,7,10,17H2,1-2H3,(H2,27,28,29,32)