N-(3,5-dimethoxyphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(3,5-dimethoxyphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(3,5-dimethoxyphenyl)acetamide IUPAC Name: N-(3,5-dimethoxyphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(3,5-dimethoxyphenyl)-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C23H23N3O3S2 MolecularWeight: 453.57702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CSC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CSC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3)OC

InChI

InChI=1S/C23H23N3O3S2/c1-28-19-11-18(12-20(14-19)29-2)24-22(27)15-31-21-10-6-9-17(13-21)26-23(30)25-16-7-4-3-5-8-16/h3-14H,15H2,1-2H3,(H,24,27)(H2,25,26,30)