4-tert-butyl-N-[3-(phenylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-(phenylcarbamothioylamino)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(phenylcarbamothioylamino)phenyl]benzamide CAS Name: N-[3-[[anilino(sulfanylidene)methyl]amino]phenyl]-4-tert-butylbenzamide IUPAC Name: 4-tert-butyl-N-[3-(phenylcarbamothioylamino)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-(phenylthiocarbamoylamino)phenyl]benzamide Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C24H25N3OS/c1-24(2,3)18-14-12-17(13-15-18)22(28)25-20-10-7-11-21(16-20)27-23(29)26-19-8-5-4-6-9-19/h4-16H,1-3H3,(H,25,28)(H2,26,27,29)