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

Systemtic Name: N-(2,4-dimethylphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(2,4-dimethylphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(2,4-dimethylphenyl)acetamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(2,4-dimethylphenyl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C23H23N3OS2 MolecularWeight: 421.57822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H23N3OS2/c1-16-8-13-21(17(2)14-16)26-22(27)15-29-20-11-9-19(10-12-20)25-23(28)24-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,26,27)(H2,24,25,28)