3-bromanyl-4-phenethyloxy-N-(1-phenylpropylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-(1-phenylpropylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-phenethyloxy-N-(1-phenylpropylcarbamothioyl)benzamide CAS Name: 3-bromo-4-phenethyloxy-N-[(1-phenylpropylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-phenethyloxy-N-(1-phenylpropylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-phenethyloxy-N-(1-phenylpropylthiocarbamoyl)benzamide Formula: C25H25BrN2O2S MolecularWeight: 497.4472

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

CCC(C1=CC=CC=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C25H25BrN2O2S/c1-2-22(19-11-7-4-8-12-19)27-25(31)28-24(29)20-13-14-23(21(26)17-20)30-16-15-18-9-5-3-6-10-18/h3-14,17,22H,2,15-16H2,1H3,(H2,27,28,29,31)