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

Systemtic Name: 4-tert-butyl-N-[4-[(phenylcarbamothioylamino)carbamoyl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[(phenylcarbamothioylamino)carbamoyl]phenyl]benzamide CAS Name: N-[4-[[[anilino(sulfanylidene)methyl]hydrazo]-oxomethyl]phenyl]-4-tert-butylbenzamide IUPAC Name: 4-tert-butyl-N-[4-[(phenylcarbamothioylamino)carbamoyl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[(phenylthiocarbamoylamino)carbamoyl]phenyl]benzamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O2S/c1-25(2,3)19-13-9-17(10-14-19)22(30)26-21-15-11-18(12-16-21)23(31)28-29-24(32)27-20-7-5-4-6-8-20/h4-16H,1-3H3,(H,26,30)(H,28,31)(H2,27,29,32)