4-tert-butyl-N-[[4-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[4-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[[4-[oxo-[(phenylmethyl)amino]methyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-4-tert-butylbenzamide Traditional Name: N-[[4-(benzylcarbamoyl)phenyl]thiocarbamoyl]-4-tert-butyl-benzamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O2S/c1-26(2,3)21-13-9-20(10-14-21)24(31)29-25(32)28-22-15-11-19(12-16-22)23(30)27-17-18-7-5-4-6-8-18/h4-16H,17H2,1-3H3,(H,27,30)(H2,28,29,31,32)