N-(2,3-dimethylphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-propanamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(2,3-dimethylphenyl)propanamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylpropanamide Traditional Name: N-(2,3-dimethylphenyl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]propionamide Formula: C24H25N3OS2 MolecularWeight: 435.6048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3)C

InChI

InChI=1S/C24H25N3OS2/c1-16-8-7-11-22(17(16)2)27-23(28)18(3)30-21-14-12-20(13-15-21)26-24(29)25-19-9-5-4-6-10-19/h4-15,18H,1-3H3,(H,27,28)(H2,25,26,29)