N-[(2,6-dimethylphenyl)carbamothioyl]-3-phenethyloxy-benzamide

Systemtic Name: N-[(2,6-dimethylphenyl)carbamothioyl]-3-phenethyloxy-benzamide Openeye Name: N-[(2,6-dimethylphenyl)carbamothioyl]-3-phenethyloxy-benzamide CAS Name: N-[(2,6-dimethylanilino)-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-[(2,6-dimethylphenyl)carbamothioyl]-3-phenethyloxybenzamide Traditional Name: N-[(2,6-dimethylphenyl)thiocarbamoyl]-3-phenethyloxy-benzamide Formula: C24H24N2O2S MolecularWeight: 404.52456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C24H24N2O2S/c1-17-8-6-9-18(2)22(17)25-24(29)26-23(27)20-12-7-13-21(16-20)28-15-14-19-10-4-3-5-11-19/h3-13,16H,14-15H2,1-2H3,(H2,25,26,27,29)