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

Systemtic Name: 4-tert-butyl-N-[3-[(4-methoxyphenyl)carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[(4-methoxybenzoyl)carbamothioylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[(4-methoxybenzoyl)carbamothioylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-(p-anisoylthiocarbamoylamino)phenyl]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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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)C3=CC=C(C=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O3S/c1-26(2,3)19-12-8-17(9-13-19)23(30)27-20-6-5-7-21(16-20)28-25(33)29-24(31)18-10-14-22(32-4)15-11-18/h5-16H,1-4H3,(H,27,30)(H2,28,29,31,33)