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

Systemtic Name: N-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-propanamide Openeye Name: N-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-propanamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-phenylpropanamide IUPAC Name: N-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylpropanamide Traditional Name: N-phenyl-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]propionamide Formula: C22H21N3OS2 MolecularWeight: 407.55164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)SC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C22H21N3OS2/c1-16(21(26)23-17-8-4-2-5-9-17)28-20-14-12-19(13-15-20)25-22(27)24-18-10-6-3-7-11-18/h2-16H,1H3,(H,23,26)(H2,24,25,27)