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

Systemtic Name: N-[4-[(butanoylcarbamothioylamino)carbamoyl]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[4-[(butanoylcarbamothioylamino)carbamoyl]phenyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[4-[oxo-[[(1-oxobutylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]benzamide IUPAC Name: N-[4-[(butanoylcarbamothioylamino)carbamoyl]phenyl]-4-tert-butylbenzamide Traditional Name: 4-tert-butyl-N-[4-[(butyrylthiocarbamoylamino)carbamoyl]phenyl]benzamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H28N4O3S/c1-5-6-19(28)25-22(31)27-26-21(30)16-9-13-18(14-10-16)24-20(29)15-7-11-17(12-8-15)23(2,3)4/h7-14H,5-6H2,1-4H3,(H,24,29)(H,26,30)(H2,25,27,28,31)