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

Systemtic Name: 4-tert-butyl-N-[3-(cyclopropylcarbonylcarbamothioylamino)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(cyclopropanecarbonylcarbamothioylamino)phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[[[cyclopropyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(cyclopropanecarbonylcarbamothioylamino)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-(cyclopropanecarbonylthiocarbamoylamino)phenyl]benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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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)NC(=O)C3CC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C3CC3

InChI

InChI=1S/C22H25N3O2S/c1-22(2,3)16-11-9-15(10-12-16)19(26)23-17-5-4-6-18(13-17)24-21(28)25-20(27)14-7-8-14/h4-6,9-14H,7-8H2,1-3H3,(H,23,26)(H2,24,25,27,28)